I: pbuilder: network access will be disabled during build I: Current time: Mon Mar 10 12:53:22 -12 2025 I: pbuilder-time-stamp: 1741654402 I: Building the build Environment I: extracting base tarball [/var/cache/pbuilder/unstable-reproducible-base.tgz] I: copying local configuration W: --override-config is not set; not updating apt.conf Read the manpage for details. I: mounting /proc filesystem I: mounting /sys filesystem I: creating /{dev,run}/shm I: mounting /dev/pts filesystem I: redirecting /dev/ptmx to /dev/pts/ptmx I: policy-rc.d already exists I: Copying source file I: copying [libgridxc_2.1.0-1.dsc] I: copying [./libgridxc_2.1.0.orig.tar.bz2] I: copying [./libgridxc_2.1.0-1.debian.tar.xz] I: Extracting source dpkg-source: warning: cannot verify inline signature for ./libgridxc_2.1.0-1.dsc: unsupported subcommand dpkg-source: info: extracting libgridxc in libgridxc-2.1.0 dpkg-source: info: unpacking libgridxc_2.1.0.orig.tar.bz2 dpkg-source: info: unpacking libgridxc_2.1.0-1.debian.tar.xz I: using fakeroot in build. I: Installing the build-deps I: user script /srv/workspace/pbuilder/2896939/tmp/hooks/D02_print_environment starting I: set BUILDDIR='/build/reproducible-path' BUILDUSERGECOS='first user,first room,first work-phone,first home-phone,first other' BUILDUSERNAME='pbuilder1' BUILD_ARCH='amd64' DEBIAN_FRONTEND='noninteractive' DEB_BUILD_OPTIONS='buildinfo=+all reproducible=+all parallel=20 ' DISTRIBUTION='unstable' HOME='/root' HOST_ARCH='amd64' IFS=' ' INVOCATION_ID='6a049f5066f14e4e911fa701ed809589' 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='2896939' PS1='# ' PS2='> ' 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.EqwI6T7e/pbuilderrc_3dCJ --distribution unstable --hookdir /etc/pbuilder/first-build-hooks --debbuildopts -b --basetgz /var/cache/pbuilder/unstable-reproducible-base.tgz --buildresult /srv/reproducible-results/rbuild-debian/r-b-build.EqwI6T7e/b1 --logfile b1/build.log libgridxc_2.1.0-1.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' I: uname -a Linux ionos11-amd64 6.1.0-31-amd64 #1 SMP PREEMPT_DYNAMIC Debian 6.1.128-1 (2025-02-07) x86_64 GNU/Linux I: ls -l /bin lrwxrwxrwx 1 root root 7 Mar 4 11:20 /bin -> usr/bin I: user script /srv/workspace/pbuilder/2896939/tmp/hooks/D02_print_environment finished -> Attempting to satisfy build-dependencies -> Creating pbuilder-satisfydepends-dummy package Package: pbuilder-satisfydepends-dummy Version: 0.invalid.0 Architecture: amd64 Maintainer: Debian Pbuilder Team Description: Dummy package to satisfy dependencies with aptitude - created by pbuilder This package was created automatically by pbuilder to satisfy the build-dependencies of the package being currently built. Depends: cmake, debhelper-compat (= 12), gfortran, libxc-dev, pkg-config dpkg-deb: building package 'pbuilder-satisfydepends-dummy' in '/tmp/satisfydepends-aptitude/pbuilder-satisfydepends-dummy.deb'. Selecting previously unselected package pbuilder-satisfydepends-dummy. (Reading database ... 19783 files and directories currently installed.) Preparing to unpack .../pbuilder-satisfydepends-dummy.deb ... Unpacking pbuilder-satisfydepends-dummy (0.invalid.0) ... dpkg: pbuilder-satisfydepends-dummy: dependency problems, but configuring anyway as you requested: pbuilder-satisfydepends-dummy depends on cmake; however: Package cmake is not installed. pbuilder-satisfydepends-dummy depends on debhelper-compat (= 12); however: Package debhelper-compat is not installed. pbuilder-satisfydepends-dummy depends on gfortran; however: Package gfortran is not installed. pbuilder-satisfydepends-dummy depends on libxc-dev; however: Package libxc-dev is not installed. pbuilder-satisfydepends-dummy depends on pkg-config; however: Package pkg-config is not installed. Setting up pbuilder-satisfydepends-dummy (0.invalid.0) ... Reading package lists... Building dependency tree... Reading state information... Initializing package states... Writing extended state information... Building tag database... pbuilder-satisfydepends-dummy is already installed at the requested version (0.invalid.0) pbuilder-satisfydepends-dummy is already installed at the requested version (0.invalid.0) The following NEW packages will be installed: autoconf{a} automake{a} autopoint{a} autotools-dev{a} bsdextrautils{a} cmake{a} cmake-data{a} debhelper{a} dh-autoreconf{a} dh-strip-nondeterminism{a} dwz{a} file{a} gettext{a} gettext-base{a} gfortran{a} gfortran-14{a} gfortran-14-x86-64-linux-gnu{a} gfortran-x86-64-linux-gnu{a} groff-base{a} intltool-debian{a} libarchive-zip-perl{a} libarchive13t64{a} libbrotli1{a} libcom-err2{a} libcurl4t64{a} libdebhelper-perl{a} libelf1t64{a} libexpat1{a} libffi8{a} libfile-stripnondeterminism-perl{a} libgfortran-14-dev{a} libgfortran5{a} libgnutls30t64{a} libgssapi-krb5-2{a} libicu72{a} libidn2-0{a} libjsoncpp26{a} libk5crypto3{a} libkeyutils1{a} libkrb5-3{a} libkrb5support0{a} libldap2{a} libmagic-mgc{a} libmagic1t64{a} libnghttp2-14{a} libnghttp3-9{a} libp11-kit0{a} libpipeline1{a} libpkgconf3{a} libproc2-0{a} libpsl5t64{a} librhash1{a} librtmp1{a} libsasl2-2{a} libsasl2-modules-db{a} libssh2-1t64{a} libtasn1-6{a} libtool{a} libuchardet0{a} libunistring5{a} libuv1t64{a} libxc-dev{a} libxc9{a} libxml2{a} m4{a} man-db{a} pkg-config{a} pkgconf{a} pkgconf-bin{a} po-debconf{a} procps{a} sensible-utils{a} The following packages are RECOMMENDED but will NOT be installed: ca-certificates curl krb5-locales libarchive-cpio-perl libldap-common libltdl-dev libmail-sendmail-perl libsasl2-modules linux-sysctl-defaults lynx psmisc publicsuffix wget 0 packages upgraded, 72 newly installed, 0 to remove and 0 not upgraded. Need to get 65.9 MB of archives. After unpacking 238 MB will be used. Writing extended state information... Get: 1 http://deb.debian.org/debian unstable/main amd64 libproc2-0 amd64 2:4.0.4-7 [64.9 kB] Get: 2 http://deb.debian.org/debian unstable/main amd64 procps amd64 2:4.0.4-7 [878 kB] Get: 3 http://deb.debian.org/debian unstable/main amd64 sensible-utils all 0.0.24 [24.8 kB] Get: 4 http://deb.debian.org/debian unstable/main amd64 libmagic-mgc amd64 1:5.45-3+b1 [314 kB] Get: 5 http://deb.debian.org/debian unstable/main amd64 libmagic1t64 amd64 1:5.45-3+b1 [108 kB] Get: 6 http://deb.debian.org/debian unstable/main amd64 file amd64 1:5.45-3+b1 [43.3 kB] Get: 7 http://deb.debian.org/debian unstable/main amd64 gettext-base amd64 0.23.1-1 [243 kB] Get: 8 http://deb.debian.org/debian unstable/main amd64 libuchardet0 amd64 0.0.8-1+b2 [68.9 kB] Get: 9 http://deb.debian.org/debian unstable/main amd64 groff-base amd64 1.23.0-7 [1185 kB] Get: 10 http://deb.debian.org/debian unstable/main amd64 bsdextrautils amd64 2.40.4-5 [92.4 kB] Get: 11 http://deb.debian.org/debian unstable/main amd64 libpipeline1 amd64 1.5.8-1 [42.0 kB] Get: 12 http://deb.debian.org/debian unstable/main amd64 man-db amd64 2.13.0-1 [1420 kB] Get: 13 http://deb.debian.org/debian unstable/main amd64 m4 amd64 1.4.19-7 [294 kB] Get: 14 http://deb.debian.org/debian unstable/main amd64 autoconf all 2.72-3 [493 kB] Get: 15 http://deb.debian.org/debian unstable/main amd64 autotools-dev all 20220109.1 [51.6 kB] Get: 16 http://deb.debian.org/debian unstable/main amd64 automake all 1:1.17-3 [862 kB] Get: 17 http://deb.debian.org/debian unstable/main amd64 autopoint all 0.23.1-1 [770 kB] Get: 18 http://deb.debian.org/debian unstable/main amd64 cmake-data all 3.31.6-1 [2268 kB] Get: 19 http://deb.debian.org/debian unstable/main amd64 libicu72 amd64 72.1-6 [9421 kB] Get: 20 http://deb.debian.org/debian unstable/main amd64 libxml2 amd64 2.12.7+dfsg+really2.9.14-0.2+b2 [699 kB] Get: 21 http://deb.debian.org/debian unstable/main amd64 libarchive13t64 amd64 3.7.4-1.1 [349 kB] Get: 22 http://deb.debian.org/debian unstable/main amd64 libbrotli1 amd64 1.1.0-2+b7 [307 kB] Get: 23 http://deb.debian.org/debian unstable/main amd64 libkrb5support0 amd64 1.21.3-4 [32.8 kB] Get: 24 http://deb.debian.org/debian unstable/main amd64 libcom-err2 amd64 1.47.2-1 [24.0 kB] Get: 25 http://deb.debian.org/debian unstable/main amd64 libk5crypto3 amd64 1.21.3-4 [80.9 kB] Get: 26 http://deb.debian.org/debian unstable/main amd64 libkeyutils1 amd64 1.6.3-4 [9092 B] Get: 27 http://deb.debian.org/debian unstable/main amd64 libkrb5-3 amd64 1.21.3-4 [326 kB] Get: 28 http://deb.debian.org/debian unstable/main amd64 libgssapi-krb5-2 amd64 1.21.3-4 [138 kB] Get: 29 http://deb.debian.org/debian unstable/main amd64 libunistring5 amd64 1.3-1 [476 kB] Get: 30 http://deb.debian.org/debian unstable/main amd64 libidn2-0 amd64 2.3.8-1 [109 kB] Get: 31 http://deb.debian.org/debian unstable/main amd64 libsasl2-modules-db amd64 2.1.28+dfsg1-9 [19.8 kB] Get: 32 http://deb.debian.org/debian unstable/main amd64 libsasl2-2 amd64 2.1.28+dfsg1-9 [57.5 kB] Get: 33 http://deb.debian.org/debian unstable/main amd64 libldap2 amd64 2.6.9+dfsg-1 [192 kB] Get: 34 http://deb.debian.org/debian unstable/main amd64 libnghttp2-14 amd64 1.64.0-1 [75.5 kB] Get: 35 http://deb.debian.org/debian unstable/main amd64 libnghttp3-9 amd64 1.8.0-1 [67.7 kB] Get: 36 http://deb.debian.org/debian unstable/main amd64 libpsl5t64 amd64 0.21.2-1.1+b1 [57.2 kB] Get: 37 http://deb.debian.org/debian unstable/main amd64 libffi8 amd64 3.4.7-1 [23.9 kB] Get: 38 http://deb.debian.org/debian unstable/main amd64 libp11-kit0 amd64 0.25.5-3 [425 kB] Get: 39 http://deb.debian.org/debian unstable/main amd64 libtasn1-6 amd64 4.20.0-2 [49.9 kB] Get: 40 http://deb.debian.org/debian unstable/main amd64 libgnutls30t64 amd64 3.8.9-2 [1464 kB] Get: 41 http://deb.debian.org/debian unstable/main amd64 librtmp1 amd64 2.4+20151223.gitfa8646d.1-2+b5 [58.8 kB] Get: 42 http://deb.debian.org/debian unstable/main amd64 libssh2-1t64 amd64 1.11.1-1 [245 kB] Get: 43 http://deb.debian.org/debian unstable/main amd64 libcurl4t64 amd64 8.12.1-3 [369 kB] Get: 44 http://deb.debian.org/debian unstable/main amd64 libexpat1 amd64 2.6.4-1 [106 kB] Get: 45 http://deb.debian.org/debian unstable/main amd64 libjsoncpp26 amd64 1.9.6-3 [81.7 kB] Get: 46 http://deb.debian.org/debian unstable/main amd64 librhash1 amd64 1.4.5-1 [132 kB] Get: 47 http://deb.debian.org/debian unstable/main amd64 libuv1t64 amd64 1.50.0-2 [154 kB] Get: 48 http://deb.debian.org/debian unstable/main amd64 cmake amd64 3.31.6-1 [12.0 MB] Get: 49 http://deb.debian.org/debian unstable/main amd64 libdebhelper-perl all 13.24.1 [90.9 kB] Get: 50 http://deb.debian.org/debian unstable/main amd64 libtool all 2.5.4-4 [539 kB] Get: 51 http://deb.debian.org/debian unstable/main amd64 dh-autoreconf all 20 [17.1 kB] Get: 52 http://deb.debian.org/debian unstable/main amd64 libarchive-zip-perl all 1.68-1 [104 kB] Get: 53 http://deb.debian.org/debian unstable/main amd64 libfile-stripnondeterminism-perl all 1.14.1-2 [19.7 kB] Get: 54 http://deb.debian.org/debian unstable/main amd64 dh-strip-nondeterminism all 1.14.1-2 [8620 B] Get: 55 http://deb.debian.org/debian unstable/main amd64 libelf1t64 amd64 0.192-4 [189 kB] Get: 56 http://deb.debian.org/debian unstable/main amd64 dwz amd64 0.15-1+b1 [110 kB] Get: 57 http://deb.debian.org/debian unstable/main amd64 gettext amd64 0.23.1-1 [1680 kB] Get: 58 http://deb.debian.org/debian unstable/main amd64 intltool-debian all 0.35.0+20060710.6 [22.9 kB] Get: 59 http://deb.debian.org/debian unstable/main amd64 po-debconf all 1.0.21+nmu1 [248 kB] Get: 60 http://deb.debian.org/debian unstable/main amd64 debhelper all 13.24.1 [920 kB] Get: 61 http://deb.debian.org/debian unstable/main amd64 libgfortran5 amd64 14.2.0-17 [836 kB] Get: 62 http://deb.debian.org/debian unstable/main amd64 libgfortran-14-dev amd64 14.2.0-17 [879 kB] Get: 63 http://deb.debian.org/debian unstable/main amd64 gfortran-14-x86-64-linux-gnu amd64 14.2.0-17 [11.7 MB] Get: 64 http://deb.debian.org/debian unstable/main amd64 gfortran-14 amd64 14.2.0-17 [14.0 kB] Get: 65 http://deb.debian.org/debian unstable/main amd64 gfortran-x86-64-linux-gnu amd64 4:14.2.0-1 [1284 B] Get: 66 http://deb.debian.org/debian unstable/main amd64 gfortran amd64 4:14.2.0-1 [1436 B] Get: 67 http://deb.debian.org/debian unstable/main amd64 libpkgconf3 amd64 1.8.1-4 [36.4 kB] Get: 68 http://deb.debian.org/debian unstable/main amd64 libxc9 amd64 5.2.3-1+b2 [3863 kB] Get: 69 http://deb.debian.org/debian unstable/main amd64 libxc-dev amd64 5.2.3-1+b2 [7815 kB] Get: 70 http://deb.debian.org/debian unstable/main amd64 pkgconf-bin amd64 1.8.1-4 [30.2 kB] Get: 71 http://deb.debian.org/debian unstable/main amd64 pkgconf amd64 1.8.1-4 [26.2 kB] Get: 72 http://deb.debian.org/debian unstable/main amd64 pkg-config amd64 1.8.1-4 [14.0 kB] Fetched 65.9 MB in 3s (25.2 MB/s) Preconfiguring packages ... Selecting previously unselected package libproc2-0:amd64. (Reading database ... (Reading database ... 5% (Reading database ... 10% (Reading database ... 15% (Reading database ... 20% (Reading database ... 25% (Reading database ... 30% (Reading database ... 35% (Reading database ... 40% (Reading database ... 45% (Reading database ... 50% (Reading database ... 55% (Reading database ... 60% (Reading database ... 65% (Reading database ... 70% (Reading database ... 75% (Reading database ... 80% (Reading database ... 85% (Reading database ... 90% (Reading database ... 95% (Reading database ... 100% (Reading database ... 19783 files and directories currently installed.) Preparing to unpack .../00-libproc2-0_2%3a4.0.4-7_amd64.deb ... Unpacking libproc2-0:amd64 (2:4.0.4-7) ... Selecting previously unselected package procps. Preparing to unpack .../01-procps_2%3a4.0.4-7_amd64.deb ... Unpacking procps (2:4.0.4-7) ... Selecting previously unselected package sensible-utils. Preparing to unpack .../02-sensible-utils_0.0.24_all.deb ... Unpacking sensible-utils (0.0.24) ... Selecting previously unselected package libmagic-mgc. Preparing to unpack .../03-libmagic-mgc_1%3a5.45-3+b1_amd64.deb ... Unpacking libmagic-mgc (1:5.45-3+b1) ... Selecting previously unselected package libmagic1t64:amd64. Preparing to unpack .../04-libmagic1t64_1%3a5.45-3+b1_amd64.deb ... Unpacking libmagic1t64:amd64 (1:5.45-3+b1) ... Selecting previously unselected package file. Preparing to unpack .../05-file_1%3a5.45-3+b1_amd64.deb ... Unpacking file (1:5.45-3+b1) ... Selecting previously unselected package gettext-base. Preparing to unpack .../06-gettext-base_0.23.1-1_amd64.deb ... Unpacking gettext-base (0.23.1-1) ... Selecting previously unselected package libuchardet0:amd64. Preparing to unpack .../07-libuchardet0_0.0.8-1+b2_amd64.deb ... Unpacking libuchardet0:amd64 (0.0.8-1+b2) ... Selecting previously unselected package groff-base. Preparing to unpack .../08-groff-base_1.23.0-7_amd64.deb ... Unpacking groff-base (1.23.0-7) ... Selecting previously unselected package bsdextrautils. Preparing to unpack .../09-bsdextrautils_2.40.4-5_amd64.deb ... Unpacking bsdextrautils (2.40.4-5) ... Selecting previously unselected package libpipeline1:amd64. Preparing to unpack .../10-libpipeline1_1.5.8-1_amd64.deb ... Unpacking libpipeline1:amd64 (1.5.8-1) ... Selecting previously unselected package man-db. Preparing to unpack .../11-man-db_2.13.0-1_amd64.deb ... Unpacking man-db (2.13.0-1) ... Selecting previously unselected package m4. Preparing to unpack .../12-m4_1.4.19-7_amd64.deb ... Unpacking m4 (1.4.19-7) ... Selecting previously unselected package autoconf. Preparing to unpack .../13-autoconf_2.72-3_all.deb ... Unpacking autoconf (2.72-3) ... Selecting previously unselected package autotools-dev. Preparing to unpack .../14-autotools-dev_20220109.1_all.deb ... Unpacking autotools-dev (20220109.1) ... 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Selecting previously unselected package libbrotli1:amd64. Preparing to unpack .../21-libbrotli1_1.1.0-2+b7_amd64.deb ... Unpacking libbrotli1:amd64 (1.1.0-2+b7) ... Selecting previously unselected package libkrb5support0:amd64. Preparing to unpack .../22-libkrb5support0_1.21.3-4_amd64.deb ... Unpacking libkrb5support0:amd64 (1.21.3-4) ... Selecting previously unselected package libcom-err2:amd64. Preparing to unpack .../23-libcom-err2_1.47.2-1_amd64.deb ... Unpacking libcom-err2:amd64 (1.47.2-1) ... Selecting previously unselected package libk5crypto3:amd64. Preparing to unpack .../24-libk5crypto3_1.21.3-4_amd64.deb ... Unpacking libk5crypto3:amd64 (1.21.3-4) ... Selecting previously unselected package libkeyutils1:amd64. Preparing to unpack .../25-libkeyutils1_1.6.3-4_amd64.deb ... Unpacking libkeyutils1:amd64 (1.6.3-4) ... Selecting previously unselected package libkrb5-3:amd64. Preparing to unpack .../26-libkrb5-3_1.21.3-4_amd64.deb ... Unpacking libkrb5-3:amd64 (1.21.3-4) ... Selecting previously unselected package libgssapi-krb5-2:amd64. Preparing to unpack .../27-libgssapi-krb5-2_1.21.3-4_amd64.deb ... Unpacking libgssapi-krb5-2:amd64 (1.21.3-4) ... Selecting previously unselected package libunistring5:amd64. Preparing to unpack .../28-libunistring5_1.3-1_amd64.deb ... Unpacking libunistring5:amd64 (1.3-1) ... Selecting previously unselected package libidn2-0:amd64. Preparing to unpack .../29-libidn2-0_2.3.8-1_amd64.deb ... Unpacking libidn2-0:amd64 (2.3.8-1) ... Selecting previously unselected package libsasl2-modules-db:amd64. Preparing to unpack .../30-libsasl2-modules-db_2.1.28+dfsg1-9_amd64.deb ... Unpacking libsasl2-modules-db:amd64 (2.1.28+dfsg1-9) ... Selecting previously unselected package libsasl2-2:amd64. Preparing to unpack .../31-libsasl2-2_2.1.28+dfsg1-9_amd64.deb ... Unpacking libsasl2-2:amd64 (2.1.28+dfsg1-9) ... Selecting previously unselected package libldap2:amd64. Preparing to unpack .../32-libldap2_2.6.9+dfsg-1_amd64.deb ... 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I: Building the package I: Running cd /build/reproducible-path/libgridxc-2.1.0/ && env PATH="/usr/sbin:/usr/bin:/sbin:/bin:/usr/games" HOME="/nonexistent/first-build" dpkg-buildpackage -us -uc -b && env PATH="/usr/sbin:/usr/bin:/sbin:/bin:/usr/games" HOME="/nonexistent/first-build" dpkg-genchanges -S > ../libgridxc_2.1.0-1_source.changes dpkg-buildpackage: info: source package libgridxc dpkg-buildpackage: info: source version 2.1.0-1 dpkg-buildpackage: info: source distribution unstable dpkg-buildpackage: info: source changed by Michael Banck dpkg-source --before-build . dpkg-buildpackage: info: host architecture amd64 debian/rules clean dh clean --buildsystem=cmake dh_auto_clean -O--buildsystem=cmake dh_autoreconf_clean -O--buildsystem=cmake dh_clean -O--buildsystem=cmake debian/rules binary dh binary --buildsystem=cmake dh_update_autotools_config -O--buildsystem=cmake dh_autoreconf -O--buildsystem=cmake libtoolize: putting auxiliary files in AC_CONFIG_AUX_DIR, 'config/gnu'. libtoolize: copying file 'config/gnu/ltmain.sh' libtoolize: putting macros in AC_CONFIG_MACRO_DIRS, 'config/m4'. libtoolize: copying file 'config/m4/libtool.m4' libtoolize: copying file 'config/m4/ltoptions.m4' libtoolize: copying file 'config/m4/ltsugar.m4' libtoolize: copying file 'config/m4/ltversion.m4' libtoolize: copying file 'config/m4/lt~obsolete.m4' configure.ac:470: warning: AC_OUTPUT should be used without arguments. configure.ac:470: You should run autoupdate. configure.ac:273: installing 'config/gnu/compile' configure.ac:28: installing 'config/gnu/config.guess' configure.ac:28: installing 'config/gnu/config.sub' configure.ac:29: installing 'config/gnu/install-sh' configure.ac:29: installing 'config/gnu/missing' parallel-tests: installing 'config/gnu/test-driver' debian/rules override_dh_auto_configure make[1]: Entering directory '/build/reproducible-path/libgridxc-2.1.0' dh_auto_configure -- \ -DCMAKE_BUILD_TYPE= \ -DWITH_LIBXC=YES cd obj-x86_64-linux-gnu && DEB_PYTHON_INSTALL_LAYOUT=deb PKG_CONFIG=/usr/bin/pkg-config cmake -DCMAKE_INSTALL_PREFIX=/usr -DCMAKE_BUILD_TYPE=None -DCMAKE_INSTALL_SYSCONFDIR=/etc -DCMAKE_INSTALL_LOCALSTATEDIR=/var -DCMAKE_EXPORT_NO_PACKAGE_REGISTRY=ON -DCMAKE_FIND_USE_PACKAGE_REGISTRY=OFF -DCMAKE_FIND_PACKAGE_NO_PACKAGE_REGISTRY=ON -DFETCHCONTENT_FULLY_DISCONNECTED=ON -DCMAKE_INSTALL_RUNSTATEDIR=/run "-GUnix Makefiles" -DCMAKE_VERBOSE_MAKEFILE=ON -DCMAKE_INSTALL_LIBDIR=lib/x86_64-linux-gnu -DCMAKE_BUILD_TYPE= -DWITH_LIBXC=YES .. -- The Fortran compiler identification is GNU 14.2.0 -- Detecting Fortran compiler ABI info -- Detecting Fortran compiler ABI info - done -- Check for working Fortran compiler: /usr/bin/f95 - skipped -- Allowing non-prefixed variables (e.g. WITH_MPI --> LIBGRIDXC_WITH_MPI) -- >> Using value of deprecated WITH_LIBXC option variable for new variable LIBGRIDXC_WITH_LIBXC -- Setting build type to 'RelWithDebInfo' as none was specified. Using a GNU compiler -- Adding '-fallow-argument-mismatch' for GNU >= 10.0 -- Flags for Fortran-compiler (build type: RelWithDebInfo): -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace -- Flags for C-compiler (build type: RelWithDebInfo): -g -O2 -- Searching for libXC library -- Checking for module 'libxc' -- Found libxc, version 5.2.3 -- Using pkg-config to search for libxcf03 -- Checking for module 'libxcf03' -- Found libxcf03, version 5.2.3 -- Using pkg-config to search for libxcf03 - found -- Searching for libXC library - found -- Configuring libgridxc tests... -- Configuring done (2.8s) -- Generating done (0.1s) CMake Warning: Manually-specified variables were not used by the project: CMAKE_EXPORT_NO_PACKAGE_REGISTRY CMAKE_FIND_PACKAGE_NO_PACKAGE_REGISTRY FETCHCONTENT_FULLY_DISCONNECTED -- Build files have been written to: /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu make[1]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0' dh_auto_build -O--buildsystem=cmake cd obj-x86_64-linux-gnu && make -j20 "INSTALL=install --strip-program=true" VERBOSE=1 make[1]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' /usr/bin/cmake -S/build/reproducible-path/libgridxc-2.1.0 -B/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu --check-build-system CMakeFiles/Makefile.cmake 0 /usr/bin/cmake -E cmake_progress_start /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/CMakeFiles /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu//CMakeFiles/progress.marks make -f CMakeFiles/Makefile2 all make[2]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' make -f CMakeFiles/libgridxc-lib.dir/build.make CMakeFiles/libgridxc-lib.dir/depend make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' cd /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.1.0 /build/reproducible-path/libgridxc-2.1.0 /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/CMakeFiles/libgridxc-lib.dir/DependInfo.cmake "--color=" Dependee "/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/CMakeFiles/libgridxc-lib.dir/DependInfo.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/CMakeFiles/libgridxc-lib.dir/depend.internal". 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-march=native -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.1.0/src/sorting.F90 -o CMakeFiles/libgridxc-lib.dir/src/sorting.F90.o /usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_sys.mod CMakeFiles/libgridxc-lib.dir/gridxc_sys.mod.stamp GNU [ 17%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/array.F90.o [ 19%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/am05.F90.o /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.1.0/src/am05.F90 -o CMakeFiles/libgridxc-lib.dir/src/am05.F90.o /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.1.0/src/array.F90 -o CMakeFiles/libgridxc-lib.dir/src/array.F90.o [ 21%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/ldaxc.F90.o [ 23%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/interpolation.F90.o /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.1.0/src/ldaxc.F90 -o CMakeFiles/libgridxc-lib.dir/src/ldaxc.F90.o /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.1.0/src/interpolation.F90 -o CMakeFiles/libgridxc-lib.dir/src/interpolation.F90.o [ 25%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/bessph.F90.o /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.1.0/src/bessph.F90 -o CMakeFiles/libgridxc-lib.dir/src/bessph.F90.o [ 27%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/gridxc_fft_gpfa.F90.o [ 29%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/m_io.F90.o /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.1.0/src/gridxc_fft_gpfa.F90 -o CMakeFiles/libgridxc-lib.dir/src/gridxc_fft_gpfa.F90.o /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.1.0/src/m_io.F90 -o CMakeFiles/libgridxc-lib.dir/src/m_io.F90.o /usr/bin/cmake -E touch 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CMakeFiles/libgridxc-lib.dir/src/fft3d.F90.o.provides.build [ 50%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/vv_vdwxc.F90.o /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.1.0/src/vv_vdwxc.F90 -o CMakeFiles/libgridxc-lib.dir/src/vv_vdwxc.F90.o [ 52%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/fftr.F90.o /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.1.0/src/fftr.F90 -o CMakeFiles/libgridxc-lib.dir/src/fftr.F90.o /usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_fftr.mod CMakeFiles/libgridxc-lib.dir/gridxc_fftr.mod.stamp GNU /usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/fftr.F90.o.provides.build /usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_vv_vdwxc.mod CMakeFiles/libgridxc-lib.dir/gridxc_vv_vdwxc.mod.stamp GNU /usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/vv_vdwxc.F90.o.provides.build [ 54%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/vdwxc.F90.o /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.1.0/src/vdwxc.F90 -o CMakeFiles/libgridxc-lib.dir/src/vdwxc.F90.o /usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_vdwxc.mod CMakeFiles/libgridxc-lib.dir/gridxc_vdwxc.mod.stamp GNU /usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/vdwxc.F90.o.provides.build [ 56%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/xcmod.F90.o /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.1.0/src/xcmod.F90 -o CMakeFiles/libgridxc-lib.dir/src/xcmod.F90.o /usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_xcmod.mod CMakeFiles/libgridxc-lib.dir/gridxc_xcmod.mod.stamp GNU /usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/xcmod.F90.o.provides.build [ 60%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/atomxc.F90.o [ 60%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/cellxc.F90.o /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.1.0/src/atomxc.F90 -o CMakeFiles/libgridxc-lib.dir/src/atomxc.F90.o /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.1.0/src/cellxc.F90 -o CMakeFiles/libgridxc-lib.dir/src/cellxc.F90.o /usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_atom.mod CMakeFiles/libgridxc-lib.dir/gridxc_atom.mod.stamp GNU /usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/atomxc.F90.o.provides.build /usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_cell.mod CMakeFiles/libgridxc-lib.dir/gridxc_cell.mod.stamp GNU /usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/cellxc.F90.o.provides.build [ 62%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/gridxc.F90.o /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.1.0/src/gridxc.F90 -o CMakeFiles/libgridxc-lib.dir/src/gridxc.F90.o /usr/bin/cmake -E cmake_copy_f90_mod include/gridxc.mod CMakeFiles/libgridxc-lib.dir/gridxc.mod.stamp GNU [ 64%] Linking Fortran static library libgridxc.a /usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/gridxc.F90.o.provides.build /usr/bin/cmake -P CMakeFiles/libgridxc-lib.dir/cmake_clean_target.cmake /usr/bin/cmake -E cmake_link_script CMakeFiles/libgridxc-lib.dir/link.txt --verbose=1 /usr/bin/ar qc libgridxc.a "CMakeFiles/libgridxc-lib.dir/src/alloc.F90.o" "CMakeFiles/libgridxc-lib.dir/src/am05.F90.o" "CMakeFiles/libgridxc-lib.dir/src/array.F90.o" "CMakeFiles/libgridxc-lib.dir/src/atomxc.F90.o" "CMakeFiles/libgridxc-lib.dir/src/bessph.F90.o" "CMakeFiles/libgridxc-lib.dir/src/cellsubs.F90.o" "CMakeFiles/libgridxc-lib.dir/src/cellxc.F90.o" "CMakeFiles/libgridxc-lib.dir/src/chkgmx.F90.o" "CMakeFiles/libgridxc-lib.dir/src/debugxc.F90.o" "CMakeFiles/libgridxc-lib.dir/src/fft3d.F90.o" "CMakeFiles/libgridxc-lib.dir/src/fftr.F90.o" "CMakeFiles/libgridxc-lib.dir/src/ggaxc.F90.o" "CMakeFiles/libgridxc-lib.dir/src/gridxc.F90.o" "CMakeFiles/libgridxc-lib.dir/src/gridxc_config.F90.o" "CMakeFiles/libgridxc-lib.dir/src/gridxc_fft_gpfa.F90.o" "CMakeFiles/libgridxc-lib.dir/src/interpolation.F90.o" "CMakeFiles/libgridxc-lib.dir/src/ldaxc.F90.o" "CMakeFiles/libgridxc-lib.dir/src/m_io.F90.o" "CMakeFiles/libgridxc-lib.dir/src/m_walltime.F90.o" "CMakeFiles/libgridxc-lib.dir/src/mesh1d.F90.o" "CMakeFiles/libgridxc-lib.dir/src/mesh3d.F90.o" "CMakeFiles/libgridxc-lib.dir/src/minvec.F90.o" "CMakeFiles/libgridxc-lib.dir/src/moreParallelSubs.F90.o" "CMakeFiles/libgridxc-lib.dir/src/precision.F90.o" "CMakeFiles/libgridxc-lib.dir/src/radfft.F90.o" "CMakeFiles/libgridxc-lib.dir/src/sorting.F90.o" "CMakeFiles/libgridxc-lib.dir/src/sys.F90.o" "CMakeFiles/libgridxc-lib.dir/src/vdwxc.F90.o" "CMakeFiles/libgridxc-lib.dir/src/vv_vdwxc.F90.o" "CMakeFiles/libgridxc-lib.dir/src/xc_hybrids.F90.o" "CMakeFiles/libgridxc-lib.dir/src/xc_xwpbe.F90.o" "CMakeFiles/libgridxc-lib.dir/src/xcmod.F90.o" /usr/bin/ranlib libgridxc.a make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' [ 64%] Built target libgridxc-lib make -f Testers/CMakeFiles/libgridxc-test1.dir/build.make Testers/CMakeFiles/libgridxc-test1.dir/depend make -f Testers/CMakeFiles/libgridxc-test2.dir/build.make Testers/CMakeFiles/libgridxc-test2.dir/depend make -f Testers/CMakeFiles/libgridxc-test3.dir/build.make Testers/CMakeFiles/libgridxc-test3.dir/depend make -f Testers/CMakeFiles/libgridxc-test4.dir/build.make Testers/CMakeFiles/libgridxc-test4.dir/depend make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' cd /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.1.0 /build/reproducible-path/libgridxc-2.1.0/Testers /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test1.dir/DependInfo.cmake "--color=" make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' cd /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.1.0 /build/reproducible-path/libgridxc-2.1.0/Testers /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test2.dir/DependInfo.cmake "--color=" make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' cd /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.1.0 /build/reproducible-path/libgridxc-2.1.0/Testers 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/build/reproducible-path/libgridxc-2.1.0/Testers /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test_libxc2.dir/DependInfo.cmake "--color=" make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' cd /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.1.0 /build/reproducible-path/libgridxc-2.1.0/Testers /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test_libxc.dir/DependInfo.cmake "--color=" make -f Testers/CMakeFiles/libgridxc-test_match.dir/build.make Testers/CMakeFiles/libgridxc-test_match.dir/depend make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' cd /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.1.0 /build/reproducible-path/libgridxc-2.1.0/Testers /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test_match.dir/DependInfo.cmake "--color=" make -f Testers/CMakeFiles/libgridxc-test_hse06.dir/build.make Testers/CMakeFiles/libgridxc-test_hse06.dir/depend make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' cd /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.1.0 /build/reproducible-path/libgridxc-2.1.0/Testers 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Dependee "/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test2.dir/depend.internal". Scanning dependencies of target libgridxc-test2 Dependee "/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test3.dir/DependInfo.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test3.dir/depend.internal". Dependee "/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test3.dir/depend.internal". 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Dependee "/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test4.dir/depend.internal". Dependee "/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test_libxc.dir/DependInfo.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test_libxc.dir/depend.internal". Dependee "/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test_libxc.dir/depend.internal". make -f Testers/CMakeFiles/libgridxc-test2.dir/build.make Testers/CMakeFiles/libgridxc-test2.dir/build Scanning dependencies of target libgridxc-test_libxc2 make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' Scanning dependencies of target libgridxc-test4 Scanning dependencies of target libgridxc-test_libxc make -f Testers/CMakeFiles/libgridxc-test3.dir/build.make Testers/CMakeFiles/libgridxc-test3.dir/build make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' make -f Testers/CMakeFiles/libgridxc-test4.dir/build.make Testers/CMakeFiles/libgridxc-test4.dir/build make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' make -f Testers/CMakeFiles/libgridxc-test_libxc2.dir/build.make Testers/CMakeFiles/libgridxc-test_libxc2.dir/build make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' Dependee "/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test1.dir/DependInfo.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test1.dir/depend.internal". make -f Testers/CMakeFiles/libgridxc-test_libxc.dir/build.make Testers/CMakeFiles/libgridxc-test_libxc.dir/build Dependee "/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test1.dir/depend.internal". make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' Dependee "/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test6.dir/DependInfo.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test6.dir/depend.internal". Scanning dependencies of target libgridxc-test1 make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' Dependee "/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test6.dir/depend.internal". Scanning dependencies of target libgridxc-test6 Dependee "/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test_match.dir/DependInfo.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test_match.dir/depend.internal". Dependee "/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test_match.dir/depend.internal". make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' Scanning dependencies of target libgridxc-test_match Dependee "/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test_hse06.dir/DependInfo.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test_hse06.dir/depend.internal". Dependee "/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test_hse06.dir/depend.internal". make -f Testers/CMakeFiles/libgridxc-test1.dir/build.make Testers/CMakeFiles/libgridxc-test1.dir/build make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' Scanning dependencies of target libgridxc-test_hse06 make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' make -f Testers/CMakeFiles/libgridxc-test6.dir/build.make Testers/CMakeFiles/libgridxc-test6.dir/build [ 66%] Building Fortran object Testers/CMakeFiles/libgridxc-test3.dir/test3.F90.o make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' cd /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers && /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace -c /build/reproducible-path/libgridxc-2.1.0/Testers/test3.F90 -o CMakeFiles/libgridxc-test3.dir/test3.F90.o [ 68%] Building Fortran object Testers/CMakeFiles/libgridxc-test4.dir/test4.F90.o cd /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers && /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace -c /build/reproducible-path/libgridxc-2.1.0/Testers/test4.F90 -o CMakeFiles/libgridxc-test4.dir/test4.F90.o [ 70%] Building Fortran object Testers/CMakeFiles/libgridxc-test_libxc2.dir/test_libxc2.F90.o make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' make -f Testers/CMakeFiles/libgridxc-test_match.dir/build.make Testers/CMakeFiles/libgridxc-test_match.dir/build cd /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers && /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace -c /build/reproducible-path/libgridxc-2.1.0/Testers/test_libxc2.F90 -o CMakeFiles/libgridxc-test_libxc2.dir/test_libxc2.F90.o make -f Testers/CMakeFiles/libgridxc-test_hse06.dir/build.make Testers/CMakeFiles/libgridxc-test_hse06.dir/build make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' [ 72%] Building Fortran object Testers/CMakeFiles/libgridxc-test2.dir/test2.F90.o [ 74%] Building Fortran object Testers/CMakeFiles/libgridxc-test_libxc.dir/test_libxc.F90.o cd /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers && /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace -c /build/reproducible-path/libgridxc-2.1.0/Testers/test_libxc.F90 -o CMakeFiles/libgridxc-test_libxc.dir/test_libxc.F90.o [ 76%] Building Fortran object Testers/CMakeFiles/libgridxc-test1.dir/test1.f90.o cd /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers && /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace -c /build/reproducible-path/libgridxc-2.1.0/Testers/test2.F90 -o CMakeFiles/libgridxc-test2.dir/test2.F90.o cd /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers && /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace -c /build/reproducible-path/libgridxc-2.1.0/Testers/test1.f90 -o CMakeFiles/libgridxc-test1.dir/test1.f90.o [ 78%] Building Fortran object Testers/CMakeFiles/libgridxc-test6.dir/test6.f90.o [ 80%] Building Fortran object Testers/CMakeFiles/libgridxc-test_hse06.dir/test_hse06.F90.o cd /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers && /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace -c /build/reproducible-path/libgridxc-2.1.0/Testers/test_hse06.F90 -o CMakeFiles/libgridxc-test_hse06.dir/test_hse06.F90.o cd /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers && /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace -c /build/reproducible-path/libgridxc-2.1.0/Testers/test6.f90 -o CMakeFiles/libgridxc-test6.dir/test6.f90.o [ 82%] Building Fortran object Testers/CMakeFiles/libgridxc-test_match.dir/test_match.F90.o cd /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers && /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace -c /build/reproducible-path/libgridxc-2.1.0/Testers/test_match.F90 -o CMakeFiles/libgridxc-test_match.dir/test_match.F90.o [ 84%] Linking Fortran executable libgridxc-test_libxc cd /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers && /usr/bin/cmake -E cmake_link_script CMakeFiles/libgridxc-test_libxc.dir/link.txt --verbose=1 [ 86%] Linking Fortran executable libgridxc-test_hse06 cd /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers && /usr/bin/cmake -E cmake_link_script CMakeFiles/libgridxc-test_hse06.dir/link.txt --verbose=1 [ 88%] Linking Fortran executable libgridxc-test_libxc2 cd /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers && /usr/bin/cmake -E cmake_link_script CMakeFiles/libgridxc-test_libxc2.dir/link.txt --verbose=1 [ 90%] Linking Fortran executable libgridxc-test2 cd /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers && /usr/bin/cmake -E cmake_link_script CMakeFiles/libgridxc-test2.dir/link.txt --verbose=1 [ 92%] Linking Fortran executable libgridxc-test_match cd /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers && /usr/bin/cmake -E cmake_link_script CMakeFiles/libgridxc-test_match.dir/link.txt --verbose=1 /usr/bin/f95 -Wl,-z,relro -Wl,--dependency-file=CMakeFiles/libgridxc-test_libxc.dir/link.d -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace "CMakeFiles/libgridxc-test_libxc.dir/test_libxc.F90.o" -o libgridxc-test_libxc ../libgridxc.a /usr/lib/x86_64-linux-gnu/libxcf03.so /usr/lib/x86_64-linux-gnu/libxc.so [ 94%] Linking Fortran executable libgridxc-test6 cd /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers && /usr/bin/cmake -E cmake_link_script CMakeFiles/libgridxc-test6.dir/link.txt --verbose=1 make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' /usr/bin/f95 -Wl,-z,relro -Wl,--dependency-file=CMakeFiles/libgridxc-test_hse06.dir/link.d -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace "CMakeFiles/libgridxc-test_hse06.dir/test_hse06.F90.o" -o libgridxc-test_hse06 ../libgridxc.a /usr/lib/x86_64-linux-gnu/libxcf03.so /usr/lib/x86_64-linux-gnu/libxc.so make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' [ 94%] Built target libgridxc-test_libxc [ 94%] Built target libgridxc-test_hse06 /usr/bin/f95 -Wl,-z,relro -Wl,--dependency-file=CMakeFiles/libgridxc-test_libxc2.dir/link.d -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace "CMakeFiles/libgridxc-test_libxc2.dir/test_libxc2.F90.o" -o libgridxc-test_libxc2 ../libgridxc.a /usr/lib/x86_64-linux-gnu/libxcf03.so /usr/lib/x86_64-linux-gnu/libxc.so make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' [ 94%] Built target libgridxc-test_libxc2 /usr/bin/f95 -Wl,-z,relro -Wl,--dependency-file=CMakeFiles/libgridxc-test2.dir/link.d -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace "CMakeFiles/libgridxc-test2.dir/test2.F90.o" -o libgridxc-test2 ../libgridxc.a /usr/lib/x86_64-linux-gnu/libxcf03.so /usr/lib/x86_64-linux-gnu/libxc.so make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' /usr/bin/f95 -Wl,-z,relro -Wl,--dependency-file=CMakeFiles/libgridxc-test_match.dir/link.d -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace "CMakeFiles/libgridxc-test_match.dir/test_match.F90.o" -o libgridxc-test_match ../libgridxc.a /usr/lib/x86_64-linux-gnu/libxcf03.so /usr/lib/x86_64-linux-gnu/libxc.so make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' /usr/bin/f95 -Wl,-z,relro -Wl,--dependency-file=CMakeFiles/libgridxc-test6.dir/link.d -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace "CMakeFiles/libgridxc-test6.dir/test6.f90.o" -o libgridxc-test6 ../libgridxc.a /usr/lib/x86_64-linux-gnu/libxcf03.so /usr/lib/x86_64-linux-gnu/libxc.so make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' [ 96%] Linking Fortran executable libgridxc-test1 [ 96%] Built target libgridxc-test_match cd /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers && /usr/bin/cmake -E cmake_link_script CMakeFiles/libgridxc-test1.dir/link.txt --verbose=1 [ 98%] Linking Fortran executable libgridxc-test4 cd /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers && /usr/bin/cmake -E cmake_link_script CMakeFiles/libgridxc-test4.dir/link.txt --verbose=1 [ 98%] Built target libgridxc-test6 [ 98%] Built target libgridxc-test2 /usr/bin/f95 -Wl,-z,relro -Wl,--dependency-file=CMakeFiles/libgridxc-test1.dir/link.d -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace "CMakeFiles/libgridxc-test1.dir/test1.f90.o" -o libgridxc-test1 ../libgridxc.a /usr/lib/x86_64-linux-gnu/libxcf03.so /usr/lib/x86_64-linux-gnu/libxc.so make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' [ 98%] Built target libgridxc-test1 /usr/bin/f95 -Wl,-z,relro -Wl,--dependency-file=CMakeFiles/libgridxc-test4.dir/link.d -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace "CMakeFiles/libgridxc-test4.dir/test4.F90.o" -o libgridxc-test4 ../libgridxc.a /usr/lib/x86_64-linux-gnu/libxcf03.so /usr/lib/x86_64-linux-gnu/libxc.so make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' [ 98%] Built target libgridxc-test4 [100%] Linking Fortran executable libgridxc-test3 cd /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers && /usr/bin/cmake -E cmake_link_script CMakeFiles/libgridxc-test3.dir/link.txt --verbose=1 /usr/bin/f95 -Wl,-z,relro -Wl,--dependency-file=CMakeFiles/libgridxc-test3.dir/link.d -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -fcf-protection -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace "CMakeFiles/libgridxc-test3.dir/test3.F90.o" -o libgridxc-test3 ../libgridxc.a /usr/lib/x86_64-linux-gnu/libxcf03.so /usr/lib/x86_64-linux-gnu/libxc.so make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' [100%] Built target libgridxc-test3 make[2]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' /usr/bin/cmake -E cmake_progress_start /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/CMakeFiles 0 make[1]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' dh_auto_test -O--buildsystem=cmake cd obj-x86_64-linux-gnu && make -j20 test ARGS\+=--verbose ARGS\+=-j20 make[1]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' Running tests... /usr/bin/ctest --force-new-ctest-process --verbose -j20 UpdateCTestConfiguration from :/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/DartConfiguration.tcl UpdateCTestConfiguration from :/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/DartConfiguration.tcl Test project /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu Constructing a list of tests Done constructing a list of tests Updating test list for fixtures Added 0 tests to meet fixture requirements Checking test dependency graph... Checking test dependency graph end Connected to MAKE jobserver test 1 Start 1: libgridxc_test1 1: Test command: /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers/libgridxc-test1 1: Working Directory: /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers 1: Test timeout computed to be: 10000000 test 2 Start 2: libgridxc_test2 2: Test command: /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers/libgridxc-test2 2: Working Directory: /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers 2: Test timeout computed to be: 10000000 test 3 Start 3: libgridxc_test3 3: Test command: /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers/libgridxc-test3 3: Working Directory: /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers 3: Test timeout computed to be: 10000000 test 4 Start 4: libgridxc_test4 4: Test command: /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers/libgridxc-test4 4: Working Directory: /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers 4: Test timeout computed to be: 10000000 test 5 Start 5: libgridxc_test6 5: Test command: /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers/libgridxc-test6 5: Working Directory: /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers 5: Test timeout computed to be: 10000000 test 6 Start 6: libgridxc_test_libxc 6: Test command: /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers/libgridxc-test_libxc 6: Working Directory: /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers 6: Test timeout computed to be: 10000000 test 7 Start 7: libgridxc_test_libxc2 7: Test command: /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers/libgridxc-test_libxc2 7: Working Directory: /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers 7: Test timeout computed to be: 10000000 test 8 Start 8: libgridxc_test_match 8: Test command: /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers/libgridxc-test_match 8: Working Directory: /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers 8: Test timeout computed to be: 10000000 test 9 Start 9: libgridxc_test_hse06 9: Test command: /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers/libgridxc-test_hse06 9: Working Directory: /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers 9: Test timeout computed to be: 10000000 1: 1: iSpin dens gradDens 1: 1 0.012454543 -0.042213968 -0.049800384 -0.087445317 1: 2 0.009313792 -0.034572745 -0.040770982 0.059800064 1: 3 -0.001792404 -0.041565102 -0.051024354 -0.022031202 1: 4 0.000126122 0.069545898 -0.043085606 -0.029092985 1: 1: func auth xyz iSpin Ex|Ec deriv(anal) deriv(num) diff err 1: LDA PZ 0 1 Ex -0.286794975 -0.286794983 0.000000008 0 1: LDA PZ 0 1 Ec -0.045318233 -0.045318233 0.000000000 0 1: LDA PZ 0 2 Ex -0.260107171 -0.260107171 0.000000000 0 1: LDA PZ 0 2 Ec -0.055267488 -0.055267488 0.000000000 0 1: LDA PZ 0 3 Ex 0.015230538 0.015230538 0.000000000 0 1: LDA PZ 0 3 Ec -0.005677969 -0.005677969 0.000000000 0 1: LDA PZ 0 4 Ex -0.001071693 -0.001071690 0.000000003 0 1: LDA PZ 0 4 Ec 0.000399529 0.000399528 0.000000001 0 1: 1: LDA PW92 0 1 Ex -0.286794967 -0.286794960 0.000000007 0 1: LDA PW92 0 1 Ec -0.045526830 -0.045526830 0.000000000 0 1: LDA PW92 0 2 Ex -0.260107164 -0.260107155 0.000000009 0 1: LDA PW92 0 2 Ec -0.054196335 -0.054196335 0.000000000 0 1: LDA PW92 0 3 Ex 0.015230537 0.015230537 0.000000000 0 1: LDA PW92 0 3 Ec -0.004947624 -0.004947624 0.000000000 0 1: LDA PW92 0 4 Ex -0.001071693 -0.001071690 0.000000003 0 1: LDA PW92 0 4 Ec 0.000348138 0.000348137 0.000000001 0 1: 1: GGA PW91 0 1 Ex -0.343346270 -0.786626733 0.443280463 2 1: GGA PW91 0 1 Ec -0.005089757 -0.005089757 0.000000000 0 1: GGA PW91 1 1 Ex 0.000403742 0.000403742 0.000000000 0 1: GGA PW91 1 1 Ec -0.000356059 -0.000356059 0.000000000 0 1: GGA PW91 2 1 Ex 0.002943123 0.002943123 0.000000000 0 1: GGA PW91 2 1 Ec -0.000419978 -0.000419978 0.000000000 0 1: GGA PW91 3 1 Ex 0.021883705 0.021883705 0.000000000 0 1: GGA PW91 3 1 Ec -0.000128191 -0.000128191 0.000000000 0 1: GGA PW91 0 2 Ex -0.556047583 -0.112767118 0.443280465 2 1: GGA PW91 0 2 Ec -0.005298660 -0.005298660 0.000000000 0 1: GGA PW91 1 2 Ex -0.010591035 -0.010591035 0.000000000 0 1: GGA PW91 1 2 Ec -0.000356059 -0.000356059 0.000000000 0 1: GGA PW91 2 2 Ex -0.011211740 -0.011211740 0.000000000 0 1: GGA PW91 2 2 Ec -0.000419978 -0.000419978 0.000000000 0 1: GGA PW91 3 2 Ex 0.007471451 0.007471451 0.000000000 0 1: GGA PW91 3 2 Ec -0.000128191 -0.000128191 0.000000000 0 1: GGA PW91 0 3 Ex -0.121387112 -0.516089234 0.394702122 2 1: GGA PW91 0 3 Ec -0.000119220 -0.000119220 0.000000000 0 1: GGA PW91 1 3 Ex -0.006274640 -0.006274640 0.000000000 0 1: GGA PW91 1 3 Ec -0.000000000 0.000000000 0.000000000 0 1: GGA PW91 2 3 Ex -0.008078079 -0.008078079 0.000000000 0 1: GGA PW91 2 3 Ec -0.000000000 0.000000000 0.000000000 0 1: GGA PW91 3 3 Ex -0.008224970 -0.008224970 0.000000000 0 1: GGA PW91 3 3 Ec -0.000000000 0.000000000 0.000000000 0 1: GGA PW91 0 4 Ex 0.008541375 -0.081441844 0.089983219 2 1: GGA PW91 0 4 Ec 0.000008389 0.000008389 0.000000000 0 1: GGA PW91 1 4 Ex 0.000441514 0.000441514 0.000000000 0 1: GGA PW91 1 4 Ec 0.000000000 0.000000000 0.000000000 0 1: GGA PW91 2 4 Ex 0.000568412 0.000568412 0.000000000 0 1: GGA PW91 2 4 Ec 0.000000000 0.000000000 0.000000000 0 1: GGA PW91 3 4 Ex 0.000578748 0.000578748 0.000000000 0 1: GGA PW91 3 4 Ec 0.000000000 0.000000000 0.000000000 0 1: 1: GGA PBE 0 1 Ex -0.321004021 -0.609813119 0.288809099 2 1: GGA PBE 0 1 Ec -0.003836473 -0.003836473 0.000000000 0 1: GGA PBE 1 1 Ex 0.002557269 0.002557269 0.000000000 0 1: GGA PBE 1 1 Ec -0.000276164 -0.000276164 0.000000000 0 1: GGA PBE 2 1 Ex 0.005062792 0.005062792 0.000000000 0 1: GGA PBE 2 1 Ec -0.000325740 -0.000325740 0.000000000 0 1: GGA PBE 3 1 Ex 0.018953958 0.018953958 0.000000000 0 1: GGA PBE 3 1 Ec -0.000099426 -0.000099426 0.000000000 0 1: GGA PBE 0 2 Ex -0.403125367 -0.114316267 0.288809100 2 1: GGA PBE 0 2 Ec -0.004155140 -0.004155140 0.000000000 0 1: GGA PBE 1 2 Ex 0.001182467 0.001182467 0.000000000 0 1: GGA PBE 1 2 Ec -0.000276164 -0.000276164 0.000000000 0 1: GGA PBE 2 2 Ex 0.001769403 0.001769403 0.000000000 0 1: GGA PBE 2 2 Ec -0.000325740 -0.000325740 0.000000000 0 1: GGA PBE 3 2 Ex 0.003727236 0.003727236 0.000000000 0 1: GGA PBE 3 2 Ec -0.000099426 -0.000099426 0.000000000 0 1: GGA PBE 0 3 Ex -0.046866063 -0.310440297 0.263574235 2 1: GGA PBE 0 3 Ec -0.000181861 -0.000181861 0.000000000 0 1: GGA PBE 1 3 Ex -0.000784590 -0.000784590 0.000000000 0 1: GGA PBE 1 3 Ec -0.000000000 0.000000000 0.000000000 0 1: GGA PBE 2 3 Ex -0.001879513 -0.001879513 0.000000000 0 1: GGA PBE 2 3 Ec -0.000000000 0.000000000 0.000000000 0 1: GGA PBE 3 3 Ex -0.008689781 -0.008689781 0.000000000 0 1: GGA PBE 3 3 Ec -0.000000000 0.000000000 0.000000000 0 1: GGA PBE 0 4 Ex 0.003297719 -0.146499563 0.149797282 2 1: GGA PBE 0 4 Ec 0.000012797 0.000012797 0.000000000 0 1: GGA PBE 1 4 Ex 0.000055207 0.000055207 0.000000000 0 1: GGA PBE 1 4 Ec 0.000000000 0.000000000 0.000000000 0 1: GGA PBE 2 4 Ex 0.000132251 0.000132251 0.000000000 0 1: GGA PBE 2 4 Ec 0.000000000 0.000000000 0.000000000 0 1: GGA PBE 3 4 Ex 0.000611454 0.000611454 0.000000000 0 1: GGA PBE 3 4 Ec 0.000000000 0.000000000 0.000000000 0 1: 1: GGA RPBE 0 1 Ex -0.308900899 -0.742976327 0.434075427 2 1: GGA RPBE 0 1 Ec -0.003836473 -0.003836473 0.000000000 0 1: GGA RPBE 1 1 Ex 0.003546695 0.003546695 0.000000000 0 1: GGA RPBE 1 1 Ec -0.000276164 -0.000276164 0.000000000 0 1: GGA RPBE 2 1 Ex 0.007202342 0.007202342 0.000000000 0 1: GGA RPBE 2 1 Ec -0.000325740 -0.000325740 0.000000000 0 1: GGA RPBE 3 1 Ex 0.027879880 0.027879880 0.000000000 0 1: GGA RPBE 3 1 Ec -0.000099426 -0.000099426 0.000000000 0 1: GGA RPBE 0 2 Ex -0.426242366 0.007833063 0.434075429 2 1: GGA RPBE 0 2 Ec -0.004155140 -0.004155140 0.000000000 0 1: GGA RPBE 1 2 Ex 0.000731428 0.000731428 0.000000000 0 1: GGA RPBE 1 2 Ec -0.000276164 -0.000276164 0.000000000 0 1: GGA RPBE 2 2 Ex 0.001485318 0.001485318 0.000000000 0 1: GGA RPBE 2 2 Ec -0.000325740 -0.000325740 0.000000000 0 1: GGA RPBE 3 2 Ex 0.005749555 0.005749555 0.000000000 0 1: GGA RPBE 3 2 Ec -0.000099426 -0.000099426 0.000000000 0 1: GGA RPBE 0 3 Ex -0.066965932 -0.462283727 0.395317795 2 1: GGA RPBE 0 3 Ec -0.000181861 -0.000181861 0.000000000 0 1: GGA RPBE 1 3 Ex -0.001606653 -0.001606653 0.000000000 0 1: GGA RPBE 1 3 Ec -0.000000000 0.000000000 0.000000000 0 1: GGA RPBE 2 3 Ex -0.003262664 -0.003262664 0.000000000 0 1: GGA RPBE 2 3 Ec -0.000000000 0.000000000 0.000000000 0 1: GGA RPBE 3 3 Ex -0.012629618 -0.012629618 0.000000000 0 1: GGA RPBE 3 3 Ec -0.000000000 0.000000000 0.000000000 0 1: GGA RPBE 0 4 Ex 0.004712042 -0.208634812 0.213346854 2 1: GGA RPBE 0 4 Ec 0.000012797 0.000012797 0.000000000 0 1: GGA RPBE 1 4 Ex 0.000113052 0.000113052 0.000000000 0 1: GGA RPBE 1 4 Ec 0.000000000 0.000000000 0.000000000 0 1: GGA RPBE 2 4 Ex 0.000229577 0.000229577 0.000000000 0 1: GGA RPBE 2 4 Ec 0.000000000 0.000000000 0.000000000 0 1: GGA RPBE 3 4 Ex 0.000888680 0.000888680 0.000000000 0 1: GGA RPBE 3 4 Ec 0.000000000 0.000000000 0.000000000 0 1: 1: GGA revPBE 0 1 Ex -0.306801679 -0.737072844 0.430271165 2 1: GGA revPBE 0 1 Ec -0.003836473 -0.003836473 0.000000000 0 1: GGA revPBE 1 1 Ex 0.003961936 0.003961936 0.000000000 0 1: GGA revPBE 1 1 Ec -0.000276164 -0.000276164 0.000000000 0 1: GGA revPBE 2 1 Ex 0.007751110 0.007751110 0.000000000 0 1: GGA revPBE 2 1 Ec -0.000325740 -0.000325740 0.000000000 0 1: GGA revPBE 3 1 Ex 0.028549140 0.028549140 0.000000000 0 1: GGA revPBE 3 1 Ec -0.000099426 -0.000099426 0.000000000 0 1: GGA revPBE 0 2 Ex -0.455950105 -0.025678938 0.430271167 2 1: GGA revPBE 0 2 Ec -0.004155140 -0.004155140 0.000000000 0 1: GGA revPBE 1 2 Ex 0.002297471 0.002297471 0.000000000 0 1: GGA revPBE 1 2 Ec -0.000276164 -0.000276164 0.000000000 0 1: GGA revPBE 2 2 Ex 0.003237613 0.003237613 0.000000000 0 1: GGA revPBE 2 2 Ec -0.000325740 -0.000325740 0.000000000 0 1: GGA revPBE 3 2 Ex 0.005477267 0.005477267 0.000000000 0 1: GGA revPBE 3 2 Ec -0.000099426 -0.000099426 0.000000000 0 1: GGA revPBE 0 3 Ex -0.085117935 -0.478219179 0.393101244 2 1: GGA revPBE 0 3 Ec -0.000181861 -0.000181861 0.000000000 0 1: GGA revPBE 1 3 Ex -0.000949898 -0.000949898 0.000000000 0 1: GGA revPBE 1 3 Ec -0.000000000 0.000000000 0.000000000 0 1: GGA revPBE 2 3 Ex -0.002575820 -0.002575820 0.000000000 0 1: GGA revPBE 2 3 Ec -0.000000000 0.000000000 0.000000000 0 1: GGA revPBE 3 3 Ex -0.013166952 -0.013166952 0.000000000 0 1: GGA revPBE 3 3 Ec -0.000000000 0.000000000 0.000000000 0 1: GGA revPBE 0 4 Ex 0.005989303 -0.223224368 0.229213671 2 1: GGA revPBE 0 4 Ec 0.000012797 0.000012797 0.000000000 0 1: GGA revPBE 1 4 Ex 0.000066839 0.000066839 0.000000000 0 1: GGA revPBE 1 4 Ec 0.000000000 0.000000000 0.000000000 0 1: GGA revPBE 2 4 Ex 0.000181247 0.000181247 0.000000000 0 1: GGA revPBE 2 4 Ec 0.000000000 0.000000000 0.000000000 0 1: GGA revPBE 3 4 Ex 0.000926489 0.000926489 0.000000000 0 1: GGA revPBE 3 4 Ec 0.000000000 0.000000000 0.000000000 0 1: 1: GGA LYP 0 1 Ex -0.263243001 -0.540611517 0.277368515 2 1: GGA LYP 0 1 Ec -0.107727122 -0.333095449 0.225368328 2 1: GGA LYP 1 1 Ex 0.006763585 0.006763585 0.000000000 0 1: GGA LYP 1 1 Ec -0.021431603 -0.021431603 0.000000000 0 1: GGA LYP 2 1 Ex 0.010767777 0.010767777 0.000000000 0 1: GGA LYP 2 1 Ec -0.024522172 -0.024522172 0.000000000 0 1: GGA LYP 3 1 Ex 0.027020575 0.027020575 0.000000000 0 1: GGA LYP 3 1 Ec -0.001046970 -0.001046970 0.000000000 0 1: GGA LYP 0 2 Ex -0.282114909 -0.004746393 0.277368515 2 1: GGA LYP 0 2 Ec -0.432058629 -0.206690301 0.225368328 2 1: GGA LYP 1 2 Ex 0.016311864 0.016311864 0.000000000 0 1: GGA LYP 1 2 Ec -0.033577141 -0.033577141 0.000000000 0 1: GGA LYP 2 2 Ex 0.018736889 0.018736889 0.000000000 0 1: GGA LYP 2 2 Ec -0.038433218 -0.038433218 0.000000000 0 1: GGA LYP 3 2 Ex 0.001437978 0.001437978 0.000000000 0 1: GGA LYP 3 2 Ec -0.001764081 -0.001764081 0.000000000 0 1: GGA LYP 0 3 Ex -0.010770062 -0.275948540 0.265178478 2 1: GGA LYP 0 3 Ec -0.185093662 -0.378498901 0.193405240 2 1: GGA LYP 1 3 Ex 0.005449134 0.005449134 0.000000000 0 1: GGA LYP 1 3 Ec -0.006931371 -0.006931371 0.000000000 0 1: GGA LYP 2 3 Ex 0.004547915 0.004547915 0.000000000 0 1: GGA LYP 2 3 Ec -0.007938934 -0.007938934 0.000000000 0 1: GGA LYP 3 3 Ex -0.014599805 -0.014599805 0.000000000 0 1: GGA LYP 3 3 Ec -0.000409250 -0.000409250 0.000000000 0 1: GGA LYP 0 4 Ex 0.000757833 -0.314288151 0.315045983 2 1: GGA LYP 0 4 Ec 0.013024071 0.070528417 0.057504346 2 1: GGA LYP 1 4 Ex -0.000383427 -0.000383427 0.000000000 0 1: GGA LYP 1 4 Ec 0.000487724 0.000487724 0.000000000 0 1: GGA LYP 2 4 Ex -0.000320013 -0.000320013 0.000000000 0 1: GGA LYP 2 4 Ec 0.000558621 0.000558621 0.000000000 0 1: GGA LYP 3 4 Ex 0.001027312 0.001027312 0.000000000 0 1: GGA LYP 3 4 Ec 0.000028797 0.000028797 0.000000000 0 1: 1: GGA WC 0 1 Ex -0.292641249 -0.614349155 0.321707906 2 1: GGA WC 0 1 Ec -0.003836473 -0.003836473 0.000000000 0 1: GGA WC 1 1 Ex 0.002832821 0.002832821 0.000000000 0 1: GGA WC 1 1 Ec -0.000276164 -0.000276164 0.000000000 0 1: GGA WC 2 1 Ex 0.005617909 0.005617909 0.000000000 0 1: GGA WC 2 1 Ec -0.000325740 -0.000325740 0.000000000 0 1: GGA WC 3 1 Ex 0.021080797 0.021080797 0.000000000 0 1: GGA WC 3 1 Ec -0.000099426 -0.000099426 0.000000000 0 1: GGA WC 0 2 Ex -0.394812497 -0.073104590 0.321707908 2 1: GGA WC 0 2 Ec -0.004155140 -0.004155140 0.000000000 0 1: GGA WC 1 2 Ex 0.001261668 0.001261668 0.000000000 0 1: GGA WC 1 2 Ec -0.000276164 -0.000276164 0.000000000 0 1: GGA WC 2 2 Ex 0.001908657 0.001908657 0.000000000 0 1: GGA WC 2 2 Ec -0.000325740 -0.000325740 0.000000000 0 1: GGA WC 3 2 Ex 0.004159644 0.004159644 0.000000000 0 1: GGA WC 3 2 Ec -0.000099426 -0.000099426 0.000000000 0 1: GGA WC 0 3 Ex -0.058308398 -0.351862841 0.293554443 2 1: GGA WC 0 3 Ec -0.000181861 -0.000181861 0.000000000 0 1: GGA WC 1 3 Ex -0.000896646 -0.000896646 0.000000000 0 1: GGA WC 1 3 Ec -0.000000000 0.000000000 0.000000000 0 1: GGA WC 2 3 Ex -0.002116844 -0.002116844 0.000000000 0 1: GGA WC 2 3 Ec -0.000000000 0.000000000 0.000000000 0 1: GGA WC 3 3 Ex -0.009656780 -0.009656780 0.000000000 0 1: GGA WC 3 3 Ec -0.000000000 0.000000000 0.000000000 0 1: GGA WC 0 4 Ex 0.004102856 -0.162132194 0.166235051 2 1: GGA WC 0 4 Ec 0.000012797 0.000012797 0.000000000 0 1: GGA WC 1 4 Ex 0.000063092 0.000063092 0.000000000 0 1: GGA WC 1 4 Ec 0.000000000 0.000000000 0.000000000 0 1: GGA WC 2 4 Ex 0.000148951 0.000148951 0.000000000 0 1: GGA WC 2 4 Ec 0.000000000 0.000000000 0.000000000 0 1: GGA WC 3 4 Ex 0.000679497 0.000679497 0.000000000 0 1: GGA WC 3 4 Ec 0.000000000 0.000000000 0.000000000 0 1: 1: GGA PBEJsJrLO 0 1 Ex -0.302331018 -0.583624835 0.281293816 2 1: GGA PBEJsJrLO 0 1 Ec -0.007110080 -0.007110080 0.000000000 0 1: GGA PBEJsJrLO 1 1 Ex 0.002571197 0.002571197 0.000000000 0 1: GGA PBEJsJrLO 1 1 Ec -0.000507228 -0.000507228 0.000000000 0 1: GGA PBEJsJrLO 2 1 Ex 0.005041373 0.005041373 0.000000000 0 1: GGA PBEJsJrLO 2 1 Ec -0.000598285 -0.000598285 0.000000000 0 1: GGA PBEJsJrLO 3 1 Ex 0.018625467 0.018625467 0.000000000 0 1: GGA PBEJsJrLO 3 1 Ec -0.000182616 -0.000182616 0.000000000 0 1: GGA PBEJsJrLO 0 2 Ex -0.389202408 -0.107908590 0.281293818 2 1: GGA PBEJsJrLO 0 2 Ec -0.007708041 -0.007708041 0.000000000 0 1: GGA PBEJsJrLO 1 2 Ex 0.001435210 0.001435210 0.000000000 0 1: GGA PBEJsJrLO 1 2 Ec -0.000507228 -0.000507228 0.000000000 0 1: GGA PBEJsJrLO 2 2 Ex 0.002041646 0.002041646 0.000000000 0 1: GGA PBEJsJrLO 2 2 Ec -0.000598285 -0.000598285 0.000000000 0 1: GGA PBEJsJrLO 3 2 Ex 0.003590239 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Built-in Ex, Ec, sum: -4.35557595 -0.64530376 -5.00087971 9: -0.96381 -0.96241 -0.95818 -0.95085 -0.94096 -0.92821 9: -0.91301 -0.89533 -0.87543 -0.85345 -0.82960 -0.80409 9: -0.77712 -0.74892 -0.71968 -0.68963 -0.65894 -0.62781 9: -0.59638 -0.56477 -0.53302 -0.50110 -0.46885 -0.43600 9: -0.40231 -0.36779 -0.33297 -0.29914 -0.26803 -0.24125 9: -0.21962 -0.20283 -0.18970 -0.17872 -0.16848 -0.15809 9: -0.14712 -0.13555 -0.12361 -0.11161 -0.09987 -0.08863 9: -0.07810 -0.06838 -0.05953 -0.05157 -0.04446 -0.03816 9: -0.03262 -0.02778 -0.02356 -0.01992 -0.01677 -0.01408 9: -0.01177 -0.00981 -0.00815 -0.00674 -0.00556 -0.00457 9: -0.00374 -0.00305 -0.00248 -0.00201 -0.00162 -0.00131 9: -0.00105 -0.00084 -0.00067 -0.00053 -0.00042 -0.00036 9: -0.00036 -0.00036 -0.00036 -0.00036 -0.00036 -0.00036 9: -0.00036 -0.00036 -0.00036 -0.00036 -0.00036 -0.00036 9: -0.00036 -0.00036 -0.00036 -0.00036 -0.00036 -0.00036 9: -0.00036 -0.00036 -0.00036 -0.00036 -0.00036 -0.00036 9: -0.00036 -0.00036 -0.00036 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0.00000 0.00000 1: GGA B88 0 4 Ex -0.001361909 -0.702992860 0.701630952 2 1: GGA C09 0 1 Ex -0.174435187 -0.174966927 0.000531739 2 1: GGA C09 0 2 Ex -0.158981397 -0.158449651 0.000531746 2 1: GGA C09 0 3 Ex 0.002995907 0.001008491 0.001987417 2 1: GGA C09 0 4 Ex -0.001978459 -0.002911349 0.000932890 2 1: GGA BH 0 1 Ex -0.142697244 -0.252956406 0.110259162 2 1: GGA BH 0 2 Ex -0.129998183 -0.019739013 0.110259170 2 1: GGA BH 0 3 Ex 0.002461869 -0.411375104 0.413836973 2 1: GGA BH 0 4 Ex -0.001625787 -0.197665562 0.196039775 2 1: 1: iSpin dens gradDens 1: 1 0.000764407 0.015544455 0.015553217 -0.023463058 1: 2 0.004398798 -0.000694954 -0.010936567 0.004108851 1: 3 0.000533587 0.007688496 0.022392465 0.017313580 1: 4 0.001120874 0.006425734 -0.013950890 0.014960359 1: GGA PW91 0 1 Ex -0.022822906 -0.038674323 0.015851417 2 1: GGA PW91 0 2 Ex -0.232973035 -0.217121610 0.015851425 2 1: GGA PW91 0 3 Ex -0.030853422 -0.020040609 0.010812813 2 1: GGA PW91 0 4 Ex -0.064811884 -0.095658127 0.030846243 2 1: GGA PBE 0 1 Ex -0.170162096 -0.185250059 0.015087963 2 1: GGA PBE 0 2 Ex -0.245486496 -0.230398525 0.015087971 2 1: GGA PBE 0 3 Ex -0.011058834 -0.000766440 0.010292395 2 1: GGA PBE 0 4 Ex -0.023230613 -0.052591380 0.029360767 2 1: GGA RPBE 0 1 Ex -0.172406378 -0.189281415 0.016875037 2 1: GGA RPBE 0 2 Ex -0.268745141 -0.251870094 0.016875046 2 1: GGA RPBE 0 3 Ex -0.014144081 -0.002632633 0.011511448 2 1: GGA RPBE 0 4 Ex -0.029711601 -0.062549958 0.032838357 2 1: GGA revPBE 0 1 Ex -0.204903262 -0.231359676 0.026456415 2 1: GGA revPBE 0 2 Ex -0.233965069 -0.207508645 0.026456424 2 1: GGA revPBE 0 3 Ex -0.004266741 0.013780761 0.018047502 2 1: GGA revPBE 0 4 Ex -0.008962880 -0.060446330 0.051483450 2 1: GGA LYP 0 1 Ex -0.404453102 -0.448583277 0.044130175 2 1: GGA LYP 0 1 Ec -0.652748480 -0.683954452 0.031205972 2 1: GGA LYP 0 2 Ex -0.208756826 -0.164626651 0.044130175 2 1: GGA LYP 0 2 Ec -0.395723098 -0.364517127 0.031205971 2 1: GGA LYP 0 3 Ex 0.028731364 0.060888230 0.032156866 2 1: GGA LYP 0 3 Ec 0.037735464 0.049717204 0.011981740 2 1: GGA LYP 0 4 Ex 0.060354207 -0.026499160 0.086853367 2 1: GGA LYP 0 4 Ec 0.079268565 0.022972608 0.056295958 2 1: GGA WC 0 1 Ex -0.167688448 -0.186949800 0.019261352 2 1: GGA WC 0 2 Ex -0.219766112 -0.200504752 0.019261360 2 1: GGA WC 0 3 Ex -0.007645840 0.005493480 0.013139320 2 1: GGA WC 0 4 Ex -0.016061144 -0.053543208 0.037482063 2 1: GGA PBEJsJrLO 0 1 Ex -0.168178170 -0.185043825 0.016865655 2 1: GGA PBEJsJrLO 0 2 Ex -0.224816873 -0.207951210 0.016865663 2 1: GGA PBEJsJrLO 0 3 Ex -0.008315473 0.003189596 0.011505069 2 1: GGA PBEJsJrLO 0 4 Ex -0.017467803 -0.050287908 0.032820105 2 1: GGA PBEJsJrHEG 0 1 Ex -0.148284168 -0.158626750 0.010342583 2 1: GGA PBEJsJrHEG 0 2 Ex -0.230969580 -0.220626990 0.010342590 2 1: GGA PBEJsJrHEG 0 3 Ex -0.012139550 -0.005084261 0.007055289 2 1: GGA PBEJsJrHEG 0 4 Ex -0.025500805 -0.045627198 0.020126393 2 1: GGA PBEGcGxLO 0 1 Ex -0.167207865 -0.184647117 0.017439252 2 1: GGA PBEGcGxLO 0 2 Ex -0.214734672 -0.197295412 0.017439260 2 1: GGA PBEGcGxLO 0 3 Ex -0.006977700 0.004918658 0.011896359 2 1: GGA PBEGcGxLO 0 4 Ex -0.014657626 -0.048593936 0.033936310 2 1: GGA PBEGcGxHEG 0 1 Ex -0.147521213 -0.158604204 0.011082991 2 1: GGA PBEGcGxHEG 0 2 Ex -0.223015954 -0.211932957 0.011082998 2 1: GGA PBEGcGxHEG 0 3 Ex -0.011083843 -0.003523477 0.007560367 2 1: GGA PBEGcGxHEG 0 4 Ex -0.023283147 -0.044850352 0.021567205 2 1: GGA PBESOL 0 1 Ex -0.167207865 -0.184647117 0.017439252 2 1: GGA PBESOL 0 2 Ex -0.214734672 -0.197295412 0.017439260 2 1: GGA PBESOL 0 3 Ex -0.006977700 0.004918658 0.011896359 2 1: GGA PBESOL 0 4 Ex -0.014657626 -0.048593936 0.033936310 2 1: GGA AM05 0 1 Ex -0.346200295 -0.374333702 0.028133407 2 1: GGA AM05 0 1 Ec -0.062345954 -0.062244921 0.000101033 2 1: GGA AM05 0 2 Ex -0.186544679 -0.158411272 0.028133407 2 1: GGA AM05 0 2 Ec -0.023765469 -0.023866502 0.000101033 2 1: GGA AM05 0 3 Ex 0.023440015 0.043830505 0.020390490 2 1: GGA AM05 0 3 Ec 0.005664236 0.005595315 0.000068921 2 1: GGA AM05 0 4 Ex 0.049238996 -0.006078574 0.055317570 2 1: GGA AM05 0 4 Ec 0.011898513 0.012095121 0.000196608 2 1: GGA PW86 0 1 Ex -0.368660560 -0.389037534 0.020376975 2 1: GGA PW86 0 2 Ex -0.252149188 -0.231772203 0.020376985 2 1: GGA PW86 0 3 Ex 0.017105745 0.031222766 0.014117021 2 1: GGA PW86 0 4 Ex 0.035932985 -0.003823204 0.039756189 2 1: GGA B88 0 1 Ex -0.404448220 -0.448577859 0.044129639 2 1: GGA B88 0 2 Ex -0.208752053 -0.164622395 0.044129658 2 1: GGA B88 0 3 Ex 0.028731348 0.060887751 0.032156403 2 1: GGA B88 0 4 Ex 0.060354173 -0.026498209 0.086852382 2 1: GGA C09 0 1 Ex -0.197937065 -0.233790456 0.035853391 2 1: GGA C09 0 2 Ex -0.160385468 -0.124532068 0.035853400 2 1: GGA C09 0 3 Ex 0.005513179 0.029970873 0.024457695 2 1: GGA C09 0 4 Ex 0.011581196 -0.058188469 0.069769665 2 1: GGA BH 0 1 Ex -0.362627051 -0.387117748 0.024490697 2 1: GGA BH 0 2 Ex -0.236596875 -0.212106168 0.024490707 2 1: GGA BH 0 3 Ex 0.018503259 0.035423486 0.016920228 2 1: GGA BH 0 4 Ex 0.038868656 -0.008891283 0.047759939 2 1: 1: iSpin dens gradDens 1: 1 0.001175048 0.003147966 -0.001831401 0.009338795 1: 2 0.000884942 0.001037318 -0.006444224 0.004348690 1: 3 -0.000093111 0.001665193 -0.009760601 -0.000599367 1: 4 0.000226176 -0.010156386 0.001057926 0.002179356 1: GGA PW91 0 1 Ex -0.201787185 -0.254752483 0.052965298 2 1: GGA PW91 0 2 Ex -0.090501388 -0.037536095 0.052965293 2 1: GGA PW91 0 3 Ex 0.035717692 0.031140964 0.004576728 2 1: GGA PW91 0 4 Ex -0.086762044 -0.054678066 0.032083978 2 1: GGA PBE 0 1 Ex -0.226668328 -0.224458339 0.002209988 2 1: GGA PBE 0 2 Ex -0.209745210 -0.211955217 0.002210007 2 1: GGA PBE 0 3 Ex 0.005431553 0.005570264 0.000138711 2 1: GGA PBE 0 4 Ex -0.013193815 -0.014554052 0.001360236 2 1: GGA revPBE 0 1 Ex -0.273206417 -0.268072571 0.005133845 2 1: GGA revPBE 0 2 Ex -0.257105697 -0.262239566 0.005133869 2 1: GGA revPBE 0 3 Ex 0.005167601 0.005508765 0.000341164 2 1: GGA revPBE 0 4 Ex -0.012552647 -0.015704692 0.003152045 2 1: GGA LYP 0 1 Ex -0.176702043 0.084849786 0.261551830 2 1: GGA LYP 0 1 Ec -0.315248281 -0.546414456 0.231166174 2 1: GGA LYP 0 2 Ex -0.193471162 -0.455022992 0.261551829 2 1: GGA LYP 0 2 Ec -0.517893184 -0.286727010 0.231166174 2 1: GGA LYP 0 3 Ex -0.005382126 0.179080805 0.184462932 2 1: GGA LYP 0 3 Ec -0.065039819 -0.415114768 0.350074949 2 1: GGA LYP 0 4 Ex 0.013073753 -0.078728047 0.091801800 2 1: GGA LYP 0 4 Ec 0.157988588 0.162125039 0.004136451 2 1: GGA WC 0 1 Ex -0.225050619 -0.222484581 0.002566038 2 1: GGA WC 0 2 Ex -0.208721833 -0.211287890 0.002566057 2 1: GGA WC 0 3 Ex 0.005240799 0.005510161 0.000269361 2 1: GGA WC 0 4 Ex -0.012730455 -0.014265251 0.001534796 2 1: GGA PBEJsJrLO 0 1 Ex -0.223261499 -0.220138394 0.003123104 2 1: GGA PBEJsJrLO 0 2 Ex -0.208236831 -0.211359954 0.003123123 2 1: GGA PBEJsJrLO 0 3 Ex 0.004822237 0.005027726 0.000205489 2 1: GGA PBEJsJrLO 0 4 Ex -0.011713722 -0.013632074 0.001918352 2 1: GGA PBEJsJrHEG 0 1 Ex -0.196445288 -0.194933850 0.001511438 2 1: GGA PBEJsJrHEG 0 2 Ex -0.181073079 -0.182584534 0.001511455 2 1: GGA PBEJsJrHEG 0 3 Ex 0.004933782 0.005028614 0.000094833 2 1: GGA PBEJsJrHEG 0 4 Ex -0.011984677 -0.012914976 0.000930299 2 1: GGA PBEGcGxLO 0 1 Ex -0.220882318 -0.217124944 0.003757374 2 1: GGA PBEGcGxLO 0 2 Ex -0.207173778 -0.210931171 0.003757393 2 1: GGA PBEGcGxLO 0 3 Ex 0.004399819 0.004655341 0.000255522 2 1: GGA PBEGcGxLO 0 4 Ex -0.010687626 -0.012992155 0.002304529 2 1: GGA PBEGcGxHEG 0 1 Ex -0.195263652 -0.193435003 0.001828649 2 1: GGA PBEGcGxHEG 0 2 Ex -0.180551318 -0.182379983 0.001828665 2 1: GGA PBEGcGxHEG 0 3 Ex 0.004721992 0.004839489 0.000117497 2 1: GGA PBEGcGxHEG 0 4 Ex -0.011470217 -0.012594621 0.001124404 2 1: GGA PBESOL 0 1 Ex -0.220882318 -0.217124944 0.003757374 2 1: GGA PBESOL 0 2 Ex -0.207173778 -0.210931171 0.003757393 2 1: GGA PBESOL 0 3 Ex 0.004399819 0.004655341 0.000255522 2 1: GGA PBESOL 0 4 Ex -0.010687626 -0.012992155 0.002304529 2 1: GGA AM05 0 1 Ex -0.146214405 0.024654756 0.170869161 2 1: GGA AM05 0 1 Ec -0.025686675 -0.025701677 0.000015002 2 1: GGA AM05 0 2 Ex -0.160430008 -0.331299168 0.170869161 2 1: GGA AM05 0 2 Ec -0.030387185 -0.030372183 0.000015002 2 1: GGA AM05 0 3 Ex -0.004562564 0.114028655 0.118591219 2 1: GGA AM05 0 3 Ec -0.001508650 -0.001509861 0.000001211 2 1: GGA AM05 0 4 Ex 0.011082949 -0.049679231 0.060762179 2 1: GGA AM05 0 4 Ec 0.003664671 0.003673794 0.000009123 2 1: GGA PW86 0 1 Ex -0.215923821 -0.141728111 0.074195710 2 1: GGA PW86 0 2 Ex -0.227319857 -0.301515596 0.074195739 2 1: GGA PW86 0 3 Ex -0.003657610 0.041540897 0.045198508 2 1: GGA PW86 0 4 Ex 0.008884722 -0.020091988 0.028976710 2 1: GGA B88 0 1 Ex -0.176700223 0.084850164 0.261550388 2 1: GGA B88 0 2 Ex -0.193469216 -0.455019655 0.261550439 2 1: GGA B88 0 3 Ex -0.005382086 0.179080066 0.184462152 2 1: GGA B88 0 4 Ex 0.013073655 -0.078727529 0.091801184 2 1: GGA C09 0 1 Ex -0.268671733 -0.261858997 0.006812736 2 1: GGA C09 0 2 Ex -0.257796027 -0.264608787 0.006812760 2 1: GGA C09 0 3 Ex 0.003490608 0.002972391 0.000518217 2 1: GGA C09 0 4 Ex -0.008479056 -0.013061605 0.004582549 2 1: GGA BH 0 1 Ex -0.219071547 -0.147238119 0.071833428 2 1: GGA BH 0 2 Ex -0.228007591 -0.299841047 0.071833457 2 1: GGA BH 0 3 Ex -0.002868065 0.041287461 0.044155525 2 1: GGA BH 0 4 Ex 0.006966832 -0.020924251 0.027891082 2 1: 1: iSpin dens gradDens 1: 1 0.000103300 0.000689312 0.001089242 -0.000118770 1: 2 0.000163739 -0.000724067 -0.000158789 0.000345087 1: 3 -0.000006047 0.001173586 0.001022087 -0.000289364 1: 4 -0.000054288 0.000442605 0.000415287 -0.000552126 1: GGA PW91 0 1 Ex -0.026727418 -0.042295961 0.015568543 2 1: GGA PW91 0 2 Ex -0.072202117 -0.056633579 0.015568538 2 1: GGA PW91 0 3 Ex 0.004550146 -0.071707658 0.076257804 2 1: GGA PW91 0 4 Ex 0.040846577 0.058007664 0.017161088 2 1: GGA PBE 0 1 Ex -0.101349095 -0.100768986 0.000580109 2 1: GGA PBE 0 2 Ex -0.117724073 -0.118304214 0.000580141 2 1: GGA PBE 0 3 Ex 0.001638461 0.004480004 0.002841543 2 1: GGA PBE 0 4 Ex 0.014708438 0.014068994 0.000639444 2 1: GGA revPBE 0 1 Ex -0.125025106 -0.123664821 0.001360285 2 1: GGA revPBE 0 2 Ex -0.143551337 -0.144911661 0.001360324 2 1: GGA revPBE 0 3 Ex 0.001853713 0.008516288 0.006662574 2 1: GGA revPBE 0 4 Ex 0.016640751 0.015141375 0.001499376 2 1: GGA LYP 0 1 Ex -0.130773730 -0.024906454 0.105867276 2 1: GGA LYP 0 1 Ec -0.020749165 -0.040778575 0.020029410 2 1: GGA LYP 0 2 Ex -0.108709121 -0.214576397 0.105867276 2 1: GGA LYP 0 2 Ec -0.017535405 0.002494005 0.020029410 2 1: GGA LYP 0 3 Ex -0.002207759 0.475366278 0.477574037 2 1: GGA LYP 0 3 Ec -0.000321565 -0.067662019 0.067340454 2 1: GGA LYP 0 4 Ex -0.019819015 -0.131950143 0.112131127 2 1: GGA LYP 0 4 Ec -0.002886684 0.015764195 0.018650879 2 1: GGA WC 0 1 Ex -0.101044030 -0.100338605 0.000705425 2 1: GGA WC 0 2 Ex -0.116978733 -0.117684190 0.000705457 2 1: GGA WC 0 3 Ex 0.001594408 0.005047501 0.003453093 2 1: GGA WC 0 4 Ex 0.014312971 0.013535645 0.000777326 2 1: GGA PBEJsJrLO 0 1 Ex -0.100924038 -0.100097891 0.000826147 2 1: GGA PBEJsJrLO 0 2 Ex -0.116583948 -0.117410127 0.000826179 2 1: GGA PBEJsJrLO 0 3 Ex 0.001566912 0.005613405 0.004046493 2 1: GGA PBEJsJrLO 0 4 Ex 0.014066145 0.013155517 0.000910629 2 1: GGA PBEJsJrHEG 0 1 Ex -0.087366166 -0.086969455 0.000396711 2 1: GGA PBEJsJrHEG 0 2 Ex -0.101748738 -0.102145477 0.000396738 2 1: GGA PBEJsJrHEG 0 3 Ex 0.001439104 0.003382351 0.001943248 2 1: GGA PBEJsJrHEG 0 4 Ex 0.012918807 0.012481517 0.000437290 2 1: GGA PBEGcGxLO 0 1 Ex -0.100622587 -0.099623230 0.000999356 2 1: GGA PBEGcGxLO 0 2 Ex -0.115776774 -0.116776162 0.000999388 2 1: GGA PBEGcGxLO 0 3 Ex 0.001516310 0.006411034 0.004894724 2 1: GGA PBEGcGxLO 0 4 Ex 0.013611892 0.012510356 0.001101535 2 1: GGA PBEGcGxHEG 0 1 Ex -0.087219418 -0.086737578 0.000481840 2 1: GGA PBEGcGxHEG 0 2 Ex -0.101354914 -0.101836781 0.000481867 2 1: GGA PBEGcGxHEG 0 3 Ex 0.001414381 0.003774547 0.002360166 2 1: GGA PBEGcGxHEG 0 4 Ex 0.012696877 0.012165756 0.000531120 2 1: GGA PBESOL 0 1 Ex -0.100622587 -0.099623230 0.000999356 2 1: GGA PBESOL 0 2 Ex -0.115776774 -0.116776162 0.000999388 2 1: GGA PBESOL 0 3 Ex 0.001516310 0.006411034 0.004894724 2 1: GGA PBESOL 0 4 Ex 0.013611892 0.012510356 0.001101535 2 1: GGA AM05 0 1 Ex -0.110316830 -0.042775854 0.067540976 2 1: GGA AM05 0 1 Ec -0.022332313 -0.022336827 0.000004514 2 1: GGA AM05 0 2 Ex -0.090462453 -0.158003429 0.067540976 2 1: GGA AM05 0 2 Ec -0.017139847 -0.017135333 0.000004514 2 1: GGA AM05 0 3 Ex -0.001986606 0.303744174 0.305730780 2 1: GGA AM05 0 3 Ec -0.000519552 -0.000541649 0.000022097 2 1: GGA AM05 0 4 Ex -0.017833727 -0.089487770 0.071654043 2 1: GGA AM05 0 4 Ec -0.004664010 -0.004659036 0.000004974 2 1: GGA PW86 0 1 Ex -0.142244128 -0.116716155 0.025527974 2 1: GGA PW86 0 2 Ex -0.126755910 -0.152283946 0.025528037 2 1: GGA PW86 0 3 Ex -0.001549733 0.116783175 0.118332908 2 1: GGA PW86 0 4 Ex -0.013911927 -0.041303941 0.027392014 2 1: GGA B88 0 1 Ex -0.130773556 -0.024906563 0.105866993 2 1: GGA B88 0 2 Ex -0.108709078 -0.214576225 0.105867147 2 1: GGA B88 0 3 Ex -0.002207746 0.475365883 0.477573629 2 1: GGA B88 0 4 Ex -0.019818898 -0.131949823 0.112130925 2 1: GGA C09 0 1 Ex -0.124772682 -0.122618964 0.002153718 2 1: GGA C09 0 2 Ex -0.142385053 -0.144538810 0.002153757 2 1: GGA C09 0 3 Ex 0.001762274 0.012328015 0.010565742 2 1: GGA C09 0 4 Ex 0.015819898 0.013444058 0.002375839 2 1: GGA BH 0 1 Ex -0.141440020 -0.116691318 0.024748703 2 1: GGA BH 0 2 Ex -0.127659151 -0.152407916 0.024748765 2 1: GGA BH 0 3 Ex -0.001378898 0.113238345 0.114617243 2 1: GGA BH 0 4 Ex -0.012378341 -0.038922661 0.026544320 2 1: 1: iSpin dens gradDens 1: 1 0.771722939 3.926259008 -5.321953497 -0.004630309 1: 2 0.838769302 -4.993407622 1.237011471 -1.423821320 1: 3 -0.002096600 0.728348643 0.963324273 4.634814834 1: 4 0.042693978 2.529899210 -6.605283534 -5.353750373 1: GGA PW91 0 1 Ex -1.050489555 -3.266838523 2.216348968 2 6: 1 9.200 0.000001206 -0.047188843 -0.047188796 -0.000000047 6: 1 9.400 0.000000757 -0.040518186 -0.040518098 -0.000000088 7: 1 5.400 0.001243837 -0.291048148 -0.291048145 -0.000000003 7: 1 5.600 0.000944766 -0.266406479 -0.266406482 0.000000003 1/9 Test #8: libgridxc_test_match ............. Passed 0.05 sec 2/9 Test #9: libgridxc_test_hse06 ............. Passed 0.03 sec 7: 1 5.800 0.000710460 -0.244007114 -0.244007114 -0.000000000 7: 1 6.000 0.000528944 -0.223883655 -0.223883654 -0.000000000 7: 1 6.200 0.000389881 -0.206110012 -0.206110013 0.000000001 7: 1 6.400 0.000284517 -0.190918393 -0.190918393 0.000000000 7: 1 6.600 0.000205559 -0.178797194 -0.178797196 0.000000002 1: GGA PW91 0 2 Ex -1.067890936 1.148458026 2.216348962 2 1: GGA PW91 0 3 Ex 0.000544157 2.351096392 2.350552235 2 1: GGA PW91 0 4 Ex -0.011080902 -1.635921305 1.624840403 2 1: GGA PBE 0 1 Ex -1.037703176 -3.320767864 2.283064687 2 1: GGA PBE 0 2 Ex -1.056931859 1.226132823 2.283064682 2 1: GGA PBE 0 3 Ex 0.000601298 2.424678266 2.424076968 2 1: GGA PBE 0 4 Ex -0.012244496 -1.685859257 1.673614761 2 1: GGA RPBE 0 1 Ex -1.000982873 -3.858280046 2.857297173 2 1: GGA RPBE 0 2 Ex -0.986862096 1.870435072 2.857297168 2 1: GGA RPBE 0 3 Ex -0.000441569 2.991142541 2.991584110 2 1: GGA RPBE 0 4 Ex 0.008991869 -2.087639574 2.096631443 2 1: GGA revPBE 0 1 Ex -1.010396438 -3.723360162 2.712963724 2 1: GGA revPBE 0 2 Ex -1.003038155 1.709925563 2.712963718 2 1: GGA revPBE 0 3 Ex -0.000230100 2.846613526 2.846843626 2 1: GGA revPBE 0 4 Ex 0.004685629 -1.985723477 1.990409106 2 1: GGA LYP 0 1 Ex -1.043995980 -3.380027606 2.336031626 2 1: GGA LYP 0 1 Ec -0.041399087 0.018815289 0.060214377 2 1: GGA LYP 0 2 Ex -1.051629831 1.284401795 2.336031627 2 1: GGA LYP 0 2 Ec -0.075877792 -0.136092169 0.060214377 2 1: GGA LYP 0 3 Ex 0.000238717 2.465274930 2.465036213 2 1: GGA LYP 0 3 Ec 0.001078180 -0.073900457 0.074978637 2 1: GGA LYP 0 4 Ex -0.004861106 -1.718053976 1.713192870 2 1: GGA LYP 0 4 Ec -0.021955450 0.021642674 0.043598123 2 1: GGA WC 0 1 Ex -1.078568614 -2.751967084 1.673398469 2 1: GGA WC 0 2 Ex -1.099166085 0.574232378 1.673398463 2 1: GGA WC 0 3 Ex 0.000644101 1.775997102 1.775353001 2 1: GGA WC 0 4 Ex -0.013116117 -1.239880105 1.226763988 2 1: GGA PBEJsJrLO 0 1 Ex -1.052288216 -2.881363905 1.829075689 2 1: GGA PBEJsJrLO 0 2 Ex -1.059893704 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1: GGA AM05 0 4 Ec 0.007870666 0.009063106 0.001192440 2 1: GGA PW86 0 1 Ex -0.909819683 -1.068507871 0.158688189 2 1: GGA PW86 0 2 Ex -1.000856829 -0.842168636 0.158688193 2 1: GGA PW86 0 3 Ex 0.079768871 0.111348479 0.031579608 2 1: GGA PW86 0 4 Ex -0.026490071 -0.204073195 0.177583124 2 1: GGA B88 0 1 Ex -0.732246427 -0.991467982 0.259221554 2 1: GGA B88 0 2 Ex -0.864148851 -0.604927291 0.259221560 2 1: GGA B88 0 3 Ex 0.115575980 0.169014853 0.053438873 2 1: GGA B88 0 4 Ex -0.038381087 -0.322889049 0.284507962 2 1: GGA C09 0 1 Ex -1.071018259 -1.208203656 0.137185397 2 1: GGA C09 0 2 Ex -0.952629317 -0.815443915 0.137185402 2 1: GGA C09 0 3 Ex -0.103735152 -0.077233567 0.026501585 2 1: GGA C09 0 4 Ex 0.034448922 -0.121476725 0.155925647 2 1: GGA BH 0 1 Ex -0.867749469 -1.053969521 0.186220052 2 1: GGA BH 0 2 Ex -0.836725068 -0.650505011 0.186220056 2 1: GGA BH 0 3 Ex -0.027184304 0.009391897 0.036576202 2 1: GGA BH 0 4 Ex 0.009027509 -0.200818216 0.209845725 2 1: 1: iSpin dens 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0.017739188 0.426303044 0.408563856 2 1: GGA PBEJsJrLO 0 4 Ex 0.063687314 0.058562156 0.005125158 2 1: GGA PBEJsJrHEG 0 1 Ex -0.776532292 -0.935347373 0.158815081 2 1: GGA PBEJsJrHEG 0 2 Ex -0.824659394 -0.665844290 0.158815104 2 1: GGA PBEJsJrHEG 0 3 Ex 0.015033538 0.333375443 0.318341905 2 1: GGA PBEJsJrHEG 0 4 Ex 0.053973476 0.036110125 0.017863352 2 1: GGA PBEGcGxLO 0 1 Ex -0.710846047 -0.954362750 0.243516702 2 1: GGA PBEGcGxLO 0 2 Ex -0.762024662 -0.518507935 0.243516726 2 1: GGA PBEGcGxLO 0 3 Ex 0.015986743 0.374439221 0.358452477 2 1: GGA PBEGcGxLO 0 4 Ex 0.057395679 0.066123502 0.008727824 2 1: GGA PBEGcGxHEG 0 1 Ex -0.749510741 -0.914307028 0.164796287 2 1: GGA PBEGcGxHEG 0 2 Ex -0.795559083 -0.630762774 0.164796309 2 1: GGA PBEGcGxHEG 0 3 Ex 0.014384192 0.316768184 0.302383992 2 1: GGA PBEGcGxHEG 0 4 Ex 0.051642193 0.040890352 0.010751841 2 1: GGA PBESOL 0 1 Ex -0.710846047 -0.954362750 0.243516702 2 1: GGA PBESOL 0 2 Ex -0.762024662 -0.518507935 0.243516726 2 1: GGA PBESOL 0 3 Ex 0.015986743 0.374439221 0.358452477 2 1: GGA PBESOL 0 4 Ex 0.057395679 0.066123502 0.008727824 2 1: GGA AM05 0 1 Ex -0.567787672 -0.836588947 0.268801276 2 1: GGA AM05 0 1 Ec -0.060783836 -0.059246931 0.001536905 2 1: GGA AM05 0 2 Ex -0.578596826 -0.309795550 0.268801276 2 1: GGA AM05 0 2 Ec -0.058284541 -0.059821445 0.001536905 2 1: GGA AM05 0 3 Ex 0.003376472 -0.009453360 0.012829832 2 1: GGA AM05 0 3 Ec -0.000780709 -0.005361718 0.004581010 2 1: GGA AM05 0 4 Ex 0.012122226 0.135538238 0.123416012 2 1: GGA AM05 0 4 Ec -0.002802904 -0.002212144 0.000590760 2 1: GGA PW86 0 1 Ex -0.784199936 -1.036878405 0.252678469 2 1: GGA PW86 0 2 Ex -0.821735965 -0.569057469 0.252678496 2 1: GGA PW86 0 3 Ex 0.011725188 0.222384114 0.210658926 2 1: GGA PW86 0 4 Ex 0.042095823 0.096074111 0.053978288 2 1: GGA B88 0 1 Ex -0.622927264 -1.048199997 0.425272733 2 1: GGA B88 0 2 Ex -0.643139139 -0.217866377 0.425272762 2 1: GGA B88 0 3 Ex 0.006313615 0.074696559 0.068382944 2 1: GGA B88 0 4 Ex 0.022667169 0.193223877 0.170556708 2 1: GGA C09 0 1 Ex -0.525889325 -0.947527005 0.421637680 2 1: GGA C09 0 2 Ex -0.550370017 -0.128732311 0.421637707 2 1: GGA C09 0 3 Ex 0.007647072 0.128888156 0.121241084 2 1: GGA C09 0 4 Ex 0.027454553 0.181667725 0.154213172 2 1: GGA BH 0 1 Ex -0.666598018 -1.059622484 0.393024467 2 1: GGA BH 0 2 Ex -0.765553180 -0.372528687 0.393024494 2 1: GGA BH 0 3 Ex 0.030910778 0.889592107 0.858681329 2 1: GGA BH 0 4 Ex 0.110976016 0.047028858 0.063947158 2 1: 1: iSpin dens gradDens 1: 1 0.621842330 -5.634270913 2.094062930 6.586798862 1: 2 0.840354740 1.009918542 -2.943489112 -5.882780336 1: 3 0.186707588 -0.296346576 5.714661000 -5.272235383 1: 4 -0.182143153 0.592369901 5.604212847 -1.403868108 1: GGA PW91 0 1 Ex -1.046369732 -0.658839909 0.387529823 2 1: GGA PW91 0 2 Ex -1.117545349 -1.505075167 0.387529818 2 1: GGA PW91 0 3 Ex -0.060815895 -0.125183073 0.064367178 2 1: GGA PW91 0 4 Ex 0.059329131 -0.239105791 0.298434923 2 1: GGA PBE 0 1 Ex -1.071812848 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0.010306678 -0.640127830 -0.640127832 0.000000002 7: 2 3.200 0.008826792 -0.608140908 -0.608140904 -0.000000003 7: 2 3.400 0.007484177 -0.575559240 -0.575559242 0.000000001 7: 2 3.600 0.006282640 -0.542620903 -0.542620904 0.000000001 7: 2 3.800 0.005221523 -0.509578436 -0.509578435 -0.000000001 7: 2 4.000 0.004296443 -0.476699712 -0.476699714 0.000000001 6: 2 7.000 0.000069415 -0.151110560 -0.151110563 0.000000003 6: 2 7.200 0.000048666 -0.139861549 -0.139861554 0.000000005 6: 2 7.400 0.000033779 -0.128226737 -0.128226744 0.000000006 6: 2 7.600 0.000023212 -0.116433222 -0.116433229 0.000000007 6: 2 7.800 0.000015792 -0.104762753 -0.104762762 0.000000009 6: 2 8.000 0.000010636 -0.093477793 -0.093477805 0.000000012 6: 2 8.200 0.000007092 -0.082785576 -0.082785590 0.000000014 6: 2 8.400 0.000004681 -0.072828254 -0.072828270 0.000000016 6: 2 8.600 0.000003059 -0.063687629 -0.063687643 0.000000014 6: 2 8.800 0.000001979 -0.055396187 -0.055396188 0.000000002 6: 2 9.000 0.000001268 -0.047949450 -0.047949418 -0.000000032 6: 2 9.200 0.000000804 -0.041317198 -0.041317116 -0.000000082 6: 2 9.400 0.000000504 -0.035452601 -0.035452510 -0.000000091 6: 2 9.600 0.000000313 -0.030299188 -0.030299098 -0.000000089 6: 2 9.800 0.000000193 -0.025795893 -0.025795813 -0.000000081 6: 2 10.000 0.000000117 -0.021880577 -0.021880500 -0.000000077 6: 2 10.200 0.000000071 -0.018492378 -0.018492313 -0.000000065 6: 2 10.400 0.000000042 -0.015573224 -0.015573163 -0.000000061 6: 2 10.600 0.000000025 -0.013068736 -0.013068676 -0.000000060 6: 2 10.800 0.000000015 -0.010928714 -0.010928683 -0.000000031 6: 2 11.000 0.000000008 -0.009107337 -0.009107277 -0.000000060 6: 2 11.200 0.000000005 -0.007563161 -0.007563174 0.000000013 6: 2 11.400 0.000000003 -0.006258998 -0.006258965 -0.000000033 6: 2 11.600 0.000000002 -0.005161710 -0.005161524 -0.000000187 6: avgDiffVxc, maxDiffVxc = 0.000000037 0.000000268 1: GGA revPBE 0 1 Ex -0.998181046 -0.510290783 0.487890264 2 1: GGA revPBE 0 2 Ex -1.085965554 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0.112538764 0.139061142 0.026522378 2 1: GGA revPBE 0 4 Ex -0.017466246 -0.219928648 0.202462402 2 1: GGA LYP 0 1 Ex -0.952684348 -1.016934342 0.064249994 2 1: GGA LYP 0 1 Ec -0.086923236 -0.096779682 0.009856446 2 1: GGA LYP 0 2 Ex -0.871815485 -0.807565491 0.064249994 2 1: GGA LYP 0 2 Ec -0.219452022 -0.209595576 0.009856446 2 1: GGA LYP 0 3 Ex -0.054618026 -0.059342949 0.004724923 2 1: GGA LYP 0 3 Ec 0.089508626 0.112006157 0.022497531 2 1: GGA LYP 0 4 Ex 0.008476829 -0.328438994 0.336915823 2 1: GGA LYP 0 4 Ec -0.013891922 0.084049292 0.097941213 2 1: GGA WC 0 1 Ex -1.049934571 -1.097413576 0.047479005 2 1: GGA WC 0 2 Ex -1.131441917 -1.083962904 0.047479013 2 1: GGA WC 0 3 Ex 0.055049252 0.070580584 0.015531332 2 1: GGA WC 0 4 Ex -0.008543756 -0.134946460 0.126402703 2 1: GGA PBEJsJrLO 0 1 Ex -1.015881495 -1.068953295 0.053071800 2 1: GGA PBEJsJrLO 0 2 Ex -1.099706149 -1.046634341 0.053071808 2 1: GGA PBEJsJrLO 0 3 Ex 0.056614338 0.075783213 0.019168874 2 1: GGA PBEJsJrLO 0 4 Ex 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PBESOL 0 4 Ex -0.004752487 -0.137585554 0.132833067 2 1: GGA AM05 0 1 Ex -0.954152236 -0.976242003 0.022089767 2 1: GGA AM05 0 1 Ec -0.068867098 -0.067116764 0.001750334 2 1: GGA AM05 0 2 Ex -0.796377222 -0.774287454 0.022089768 2 1: GGA AM05 0 2 Ec -0.075549989 -0.077300323 0.001750334 2 1: GGA AM05 0 3 Ex -0.106559677 -0.122997391 0.016437714 2 1: GGA AM05 0 3 Ec 0.004513558 0.003431833 0.001081726 2 1: GGA AM05 0 4 Ex 0.016538280 -0.194741506 0.211279786 2 1: GGA AM05 0 4 Ec -0.000700513 0.000678779 0.001379293 2 1: GGA PW86 0 1 Ex -1.005511621 -1.079310450 0.073798829 2 1: GGA PW86 0 2 Ex -1.075581863 -1.001783025 0.073798837 2 1: GGA PW86 0 3 Ex 0.047324745 0.072438771 0.025114026 2 1: GGA PW86 0 4 Ex -0.007344897 -0.197549663 0.190204766 2 1: GGA B88 0 1 Ex -0.952061904 -1.016285882 0.064223978 2 1: GGA B88 0 2 Ex -0.871291763 -0.807067776 0.064223986 2 1: GGA B88 0 3 Ex -0.054551351 -0.059279836 0.004728485 2 1: GGA B88 0 4 Ex 0.008466481 -0.328347985 0.336814466 2 1: GGA C09 0 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-0.713048441 -0.731799724 0.018751283 2 1: GGA PBE 0 3 Ex -0.025969960 -0.115322490 0.089352530 2 1: GGA PBE 0 4 Ex -0.028232062 0.032206857 0.060438919 2 1: GGA RPBE 0 1 Ex -0.750582170 -0.727575551 0.023006620 2 1: GGA RPBE 0 2 Ex -0.715136484 -0.738143104 0.023006620 2 1: GGA RPBE 0 3 Ex -0.014052375 -0.123803988 0.109751613 2 1: GGA RPBE 0 4 Ex -0.015276401 0.058990309 0.074266711 2 1: GGA revPBE 0 1 Ex -0.784415607 -0.762636983 0.021778624 2 1: GGA revPBE 0 2 Ex -0.839062497 -0.860841121 0.021778624 2 1: GGA revPBE 0 3 Ex 0.021664656 -0.081993656 0.103658312 2 1: GGA revPBE 0 4 Ex 0.023551746 0.093638037 0.070086290 2 1: GGA LYP 0 1 Ex -0.765807453 -0.755887762 0.009919691 2 1: GGA LYP 0 1 Ec -0.323606685 -0.299523171 0.024083514 2 1: GGA LYP 0 2 Ex -0.631565775 -0.641485465 0.009919690 2 1: GGA LYP 0 2 Ec -0.843006071 -0.867089585 0.024083514 2 1: GGA LYP 0 3 Ex -0.053219858 -0.078933706 0.025713847 2 1: GGA LYP 0 3 Ec 0.205914900 0.078102483 0.127812417 2 1: GGA LYP 0 4 Ex -0.057855551 -0.045710315 0.012145236 2 1: GGA LYP 0 4 Ec 0.223851030 0.313482067 0.089631036 2 1: GGA WC 0 1 Ex -0.810676509 -0.797476178 0.013200331 2 1: GGA WC 0 2 Ex -0.716571237 -0.729771568 0.013200331 2 1: GGA WC 0 3 Ex -0.037307856 -0.100144393 0.062836536 2 1: GGA WC 0 4 Ex -0.040557541 0.001929895 0.042487436 2 1: GGA PBEJsJrLO 0 1 Ex -0.786771555 -0.772038281 0.014733274 2 1: GGA PBEJsJrLO 0 2 Ex -0.711269684 -0.726002959 0.014733274 2 1: GGA PBEJsJrLO 0 3 Ex -0.029932573 -0.100074125 0.070141551 2 1: GGA PBEJsJrLO 0 4 Ex -0.032539838 0.014888861 0.047428699 2 1: GGA PBEJsJrHEG 0 1 Ex -0.784026016 -0.771120736 0.012905279 2 1: GGA PBEJsJrHEG 0 2 Ex -0.639146489 -0.652051768 0.012905279 2 1: GGA PBEJsJrHEG 0 3 Ex -0.057437213 -0.118933147 0.061495934 2 1: GGA PBEJsJrHEG 0 4 Ex -0.062440257 -0.020843704 0.041596554 2 1: GGA PBEGcGxLO 0 1 Ex -0.792509227 -0.779807617 0.012701610 2 1: GGA PBEGcGxLO 0 2 Ex -0.709962341 -0.722663951 0.012701610 2 1: GGA PBEGcGxLO 0 3 Ex -0.032725556 -0.093144221 0.060418664 2 1: GGA PBEGcGxLO 0 4 Ex -0.035576102 0.005265785 0.040841887 2 1: GGA PBEGcGxHEG 0 1 Ex -0.786717346 -0.775346732 0.011370615 2 1: GGA PBEGcGxHEG 0 2 Ex -0.638505374 -0.649875988 0.011370614 2 1: GGA PBEGcGxHEG 0 3 Ex -0.058758355 -0.112918346 0.054159991 2 1: GGA PBEGcGxHEG 0 4 Ex -0.063876477 -0.027247637 0.036628839 2 1: GGA PBESOL 0 1 Ex -0.792509227 -0.779807617 0.012701610 2 1: GGA PBESOL 0 2 Ex -0.709962341 -0.722663951 0.012701610 2 7: 2 4.200 0.003500077 -0.444266875 -0.444266873 -0.000000002 7: 2 4.400 0.002822947 -0.412572354 -0.412572354 -0.000000000 7: 2 4.600 0.002254159 -0.381911080 -0.381911078 -0.000000002 7: 2 4.800 0.001782061 -0.352568553 -0.352568555 0.000000002 7: 2 5.000 0.001394815 -0.324805491 -0.324805492 0.000000001 7: 2 5.200 0.001080853 -0.298841517 -0.298841517 -0.000000000 7: 2 5.400 0.000829225 -0.274842954 -0.274842955 0.000000001 7: 2 5.600 0.000629844 -0.252923338 -0.252923337 -0.000000001 7: 2 5.800 0.000473640 -0.233169001 -0.233169001 -0.000000001 7: 2 6.000 0.000352629 -0.215702309 -0.215702310 0.000000001 7: 2 6.200 0.000259921 -0.200780146 -0.200780147 0.000000001 7: 2 6.400 0.000189678 -0.188871729 -0.188871732 0.000000002 7: 2 6.600 0.000137039 -0.180551188 -0.180551190 0.000000003 7: 2 6.800 0.000098022 -0.175955357 -0.175955367 0.000000010 7: 2 7.000 0.000069415 -0.173810452 -0.173810467 0.000000015 7: 2 7.200 0.000048666 -0.170894083 -0.170894097 0.000000014 7: 2 7.400 0.000033779 -0.163293898 -0.163293894 -0.000000004 7: 2 7.600 0.000023212 -0.149116243 -0.149116198 -0.000000045 7: 2 7.800 0.000015792 -0.129929391 -0.129929289 -0.000000102 7: 2 8.000 0.000010636 -0.109368250 -0.109368094 -0.000000157 7: 2 8.200 0.000007092 -0.090658025 -0.090657833 -0.000000193 7: 2 8.400 0.000004681 -0.075347142 -0.075346959 -0.000000183 7: 2 8.600 0.000003059 -0.063522910 -0.063522832 -0.000000078 7: 2 8.800 0.000001979 -0.054565736 -0.054565986 0.000000250 7: 2 9.000 0.000001268 -0.047730494 -0.047731613 0.000001119 7: 2 9.200 0.000000804 -0.042399692 -0.042401841 0.000002149 7: 2 9.400 0.000000504 -0.038127408 -0.038129670 0.000002262 7: 2 9.600 0.000000313 -0.034608838 -0.034611088 0.000002250 7: 2 9.800 0.000000193 -0.031640567 -0.031642752 0.000002185 7: 2 10.000 0.000000117 -0.029088011 -0.029090106 0.000002095 7: 2 10.200 0.000000071 -0.026861487 -0.026863473 0.000001986 7: 2 10.400 0.000000042 -0.024899792 -0.024901677 0.000001885 7: 2 10.600 0.000000025 -0.023159554 -0.023161337 0.000001783 7: 2 10.800 0.000000015 -0.021608555 -0.021610223 0.000001668 7: 2 11.000 0.000000008 -0.020221667 -0.020223275 0.000001608 7: 2 11.200 0.000000005 -0.018978407 -0.018979877 0.000001470 7: 2 11.400 0.000000003 -0.017861495 -0.017862976 0.000001480 7: 2 11.600 0.000000002 -0.016855994 -0.016857326 0.000001332 7: avgDiffVxc, maxDiffVxc = 0.000000680 0.000002262 3/9 Test #6: libgridxc_test_libxc ............. Passed 0.19 sec 1: GGA PBESOL 0 3 Ex -0.032725556 -0.093144221 0.060418664 2 1: GGA PBESOL 0 4 Ex -0.035576102 0.005265785 0.040841887 2 1: GGA AM05 0 1 Ex -0.766114214 -0.764944254 0.001169960 2 1: GGA AM05 0 1 Ec -0.056704413 -0.057074474 0.000370061 2 1: GGA AM05 0 2 Ex -0.549368969 -0.550538929 0.001169960 2 1: GGA AM05 0 2 Ec -0.114680398 -0.114310337 0.000370061 2 1: GGA AM05 0 3 Ex -0.085928240 -0.077323548 0.008604693 2 1: GGA AM05 0 3 Ec 0.022984469 0.024749458 0.001764989 2 1: GGA AM05 0 4 Ex -0.093412984 -0.102685546 0.009272562 2 1: GGA AM05 0 4 Ec 0.024986522 0.023792277 0.001194244 2 1: GGA PW86 0 1 Ex -0.787168243 -0.769245780 0.017922464 2 1: GGA PW86 0 2 Ex -0.725055633 -0.742978097 0.017922465 2 1: GGA PW86 0 3 Ex -0.024624427 -0.103850244 0.079225818 2 1: GGA PW86 0 4 Ex -0.026769327 0.025315837 0.052085164 2 1: GGA B88 0 1 Ex -0.765495606 -0.755580340 0.009915266 2 1: GGA B88 0 2 Ex -0.631432598 -0.641347868 0.009915270 2 1: GGA B88 0 3 Ex -0.053149025 -0.078842945 0.025693920 2 1: GGA B88 0 4 Ex -0.057778548 -0.045646509 0.012132040 2 1: GGA C09 0 1 Ex -0.823793290 -0.812171311 0.011621979 2 1: GGA C09 0 2 Ex -0.864401340 -0.876023320 0.011621980 2 1: GGA C09 0 3 Ex 0.016098984 -0.039305989 0.055404973 2 1: GGA C09 0 4 Ex 0.017501280 0.054983728 0.037482448 2 1: GGA BH 0 1 Ex -0.787946912 -0.777721708 0.010225205 2 1: GGA BH 0 2 Ex -0.729001206 -0.739226412 0.010225206 2 1: GGA BH 0 3 Ex -0.023368913 -0.066076137 0.042707223 2 1: GGA BH 0 4 Ex -0.025404453 0.002018119 0.027422571 2 1: 1: iSpin dens gradDens 1: 1 1.506474827 -14.349735546 12.628030853 -6.882986330 1: 2 1.446960633 -8.391351052 -3.993395788 -1.045458259 1: 3 0.078521139 -8.233561937 0.075363735 9.217491271 1: 4 1.284461518 -10.324725650 12.736695683 7.115699338 1: GGA PW91 0 1 Ex -1.110618975 -1.185751043 0.075132069 2 1: GGA PW91 0 2 Ex -1.087633871 -1.012501791 0.075132081 2 1: GGA PW91 0 3 Ex -0.030325816 -0.099279301 0.068953486 2 1: GGA PW91 0 4 Ex -0.496074609 -0.490118797 0.005955812 2 1: GGA PBE 0 1 Ex -1.421679126 -1.503743759 0.082064634 2 1: GGA PBE 0 2 Ex -1.414549729 -1.332485085 0.082064644 2 1: GGA PBE 0 3 Ex -0.009406300 -0.091904445 0.082498145 2 1: GGA PBE 0 4 Ex -0.153869777 -0.146925353 0.006944425 2 1: GGA RPBE 0 1 Ex -1.399450604 -1.498581881 0.099131277 2 1: GGA RPBE 0 2 Ex -1.394291711 -1.295160423 0.099131288 2 1: GGA RPBE 0 3 Ex -0.006806479 -0.106189983 0.099383504 2 1: GGA RPBE 0 4 Ex -0.111341482 -0.102969446 0.008372036 2 1: GGA revPBE 0 1 Ex -1.536895915 -1.631643992 0.094748077 2 1: GGA revPBE 0 2 Ex -1.537434543 -1.442686455 0.094748088 2 1: GGA revPBE 0 3 Ex 0.000710649 -0.094809931 0.095520580 2 1: GGA revPBE 0 4 Ex 0.011624917 0.019659261 0.008034344 2 1: GGA LYP 0 1 Ex -1.327418072 -1.430304117 0.102886044 2 1: GGA LYP 0 1 Ec -0.123759203 -0.178297474 0.054538271 2 1: GGA LYP 0 2 Ex -1.315107952 -1.212221908 0.102886044 2 1: GGA LYP 0 2 Ec -0.130537788 -0.075999517 0.054538271 2 1: GGA LYP 0 3 Ex -0.016241581 -0.159477221 0.143235639 2 1: GGA LYP 0 3 Ec 0.008943450 -0.033963425 0.042906875 2 1: GGA LYP 0 4 Ex -0.265682422 -0.254542644 0.011139777 2 1: GGA LYP 0 4 Ec 0.146298410 0.150184861 0.003886451 2 1: GGA WC 0 1 Ex -1.456835311 -1.514975823 0.058140513 2 1: GGA WC 0 2 Ex -1.447747393 -1.389606869 0.058140524 2 1: GGA WC 0 3 Ex -0.011990310 -0.070576813 0.058586503 2 1: GGA WC 0 4 Ex -0.196139437 -0.191211017 0.004928419 2 1: GGA PBEJsJrLO 0 1 Ex -1.429260478 -1.493390307 0.064129829 2 1: GGA PBEJsJrLO 0 2 Ex -1.421366329 -1.357236490 0.064129840 2 1: GGA PBEJsJrLO 0 3 Ex -0.010415289 -0.075030593 0.064615304 2 1: GGA PBEJsJrLO 0 4 Ex -0.170374990 -0.164939267 0.005435723 2 1: GGA PBEJsJrHEG 0 1 Ex -1.363844861 -1.420329180 0.056484319 2 1: GGA PBEJsJrHEG 0 2 Ex -1.351520864 -1.295036535 0.056484330 2 1: GGA PBEJsJrHEG 0 3 Ex -0.016259891 -0.073041620 0.056781729 2 1: GGA PBEJsJrHEG 0 4 Ex -0.265981931 -0.261202209 0.004779721 2 1: GGA PBEGcGxLO 0 1 Ex -1.433886200 -1.489114218 0.055228019 2 1: GGA PBEGcGxLO 0 2 Ex -1.425481057 -1.370253028 0.055228029 2 1: GGA PBEGcGxLO 0 3 Ex -0.011089479 -0.066849886 0.055760407 2 1: GGA PBEGcGxLO 0 4 Ex -0.181403488 -0.176715306 0.004688182 2 1: GGA PBEGcGxHEG 0 1 Ex -1.366430000 -1.416023198 0.049593198 2 1: GGA PBEGcGxHEG 0 2 Ex -1.353843809 -1.304250600 0.049593209 2 1: GGA PBEGcGxHEG 0 3 Ex -0.016605821 -0.066512542 0.049906721 2 1: GGA PBEGcGxHEG 0 4 Ex -0.271640705 -0.267440910 0.004199795 2 1: GGA PBESOL 0 1 Ex -1.433886200 -1.489114218 0.055228019 2 1: GGA PBESOL 0 2 Ex -1.425481057 -1.370253028 0.055228029 2 1: GGA PBESOL 0 3 Ex -0.011089479 -0.066849886 0.055760407 2 1: GGA PBESOL 0 4 Ex -0.181403488 -0.176715306 0.004688182 2 1: GGA AM05 0 1 Ex -1.261727639 -1.304693761 0.042966122 2 1: GGA AM05 0 1 Ec -0.112831841 -0.111751511 0.001080331 2 1: GGA AM05 0 2 Ex -1.243996032 -1.201029910 0.042966122 2 1: GGA AM05 0 2 Ec -0.115808514 -0.116888844 0.001080331 2 1: GGA AM05 0 3 Ex -0.023394520 -0.092872789 0.069478269 2 1: GGA AM05 0 3 Ec 0.003927327 0.005010953 0.001083626 2 1: GGA AM05 0 4 Ex -0.382691355 -0.377448644 0.005242710 2 1: GGA AM05 0 4 Ec 0.064243851 0.064152580 0.000091272 2 1: GGA PW86 0 1 Ex -1.422723830 -1.520539710 0.097815880 2 1: GGA PW86 0 2 Ex -1.415457646 -1.317641754 0.097815892 2 1: GGA PW86 0 3 Ex -0.009586773 -0.119587123 0.110000350 2 1: GGA PW86 0 4 Ex -0.156821993 -0.147831407 0.008990586 2 1: GGA B88 0 1 Ex -1.325762320 -1.428558978 0.102796658 2 1: GGA B88 0 2 Ex -1.313504330 -1.210707662 0.102796668 2 1: GGA B88 0 3 Ex -0.016172803 -0.159311799 0.143138996 2 1: GGA B88 0 4 Ex -0.264557335 -0.253425542 0.011131793 2 1: GGA C09 0 1 Ex -1.599378130 -1.648889766 0.049511636 2 1: GGA C09 0 2 Ex -1.598830973 -1.549319327 0.049511647 2 1: GGA C09 0 3 Ex -0.000721901 -0.050539942 0.049818042 2 1: GGA C09 0 4 Ex -0.011808970 -0.007616485 0.004192484 2 1: GGA BH 0 1 Ex -1.438031033 -1.497835516 0.059804483 2 1: GGA BH 0 2 Ex -1.430565259 -1.370760766 0.059804493 2 1: GGA BH 0 3 Ex -0.009850106 -0.081341540 0.071491435 2 1: GGA BH 0 4 Ex -0.161129626 -0.155373758 0.005755867 2 1: 1: iSpin dens gradDens 1: 1 0.649803658 6.462775471 2.690151555 2.331452722 1: 2 2.103387043 -1.433409860 -10.299892415 3.433811181 1: 3 0.243496810 7.203054645 -9.450013636 1.792318993 1: 4 -0.536792439 0.531967941 7.126230539 -10.963935406 1: GGA PW91 0 1 Ex -1.514369076 -1.593636509 0.079267433 2 1: GGA PW91 0 2 Ex -1.522307464 -1.443040063 0.079267401 2 1: GGA PW91 0 3 Ex -0.001329798 -0.091621564 0.090291766 2 1: GGA PW91 0 4 Ex 0.002931560 0.069298253 0.066366693 2 1: GGA PBE 0 1 Ex -1.317834138 -1.411622772 0.093788634 2 1: GGA PBE 0 2 Ex -1.481726616 -1.387938014 0.093788602 2 1: GGA PBE 0 3 Ex -0.027454425 -0.128383649 0.100929224 2 1: GGA PBE 0 4 Ex 0.060523699 0.141726110 0.081202411 2 1: GGA RPBE 0 1 Ex -1.547206639 -1.646161778 0.098955139 2 1: GGA RPBE 0 2 Ex -1.480926343 -1.381971235 0.098955109 2 1: GGA RPBE 0 3 Ex 0.011102934 -0.099201523 0.110304457 2 1: GGA RPBE 0 4 Ex -0.024476588 0.059468288 0.083944876 2 1: GGA revPBE 0 1 Ex -1.316004501 -1.431325824 0.115321322 2 1: GGA revPBE 0 2 Ex -1.460137568 -1.344816275 0.115321292 2 1: GGA revPBE 0 3 Ex -0.024144430 -0.143286925 0.119142495 2 1: GGA revPBE 0 4 Ex 0.053226764 0.155321620 0.102094856 2 1: GGA LYP 0 1 Ex -0.954475011 -1.087475976 0.133000965 2 1: GGA LYP 0 1 Ec -0.041783578 -0.067671399 0.025887821 2 1: GGA LYP 0 2 Ex -1.449324101 -1.316323135 0.133000966 2 1: GGA LYP 0 2 Ec -0.000682573 0.025205248 0.025887821 2 1: GGA LYP 0 3 Ex -0.082894574 -0.208738501 0.125843927 2 1: GGA LYP 0 3 Ec 0.006885029 -0.027446409 0.034331438 2 1: GGA LYP 0 4 Ex 0.182742354 0.305734776 0.122992422 2 1: GGA LYP 0 4 Ec -0.015178151 0.004299503 0.019477654 2 1: GGA WC 0 1 Ex -1.263458161 -1.339094254 0.075636093 2 1: GGA WC 0 2 Ex -1.522666537 -1.447030476 0.075636061 2 1: GGA WC 0 3 Ex -0.043421253 -0.122051097 0.078629844 2 1: GGA WC 0 4 Ex 0.095722817 0.162462863 0.066740046 2 1: GGA PBEJsJrLO 0 1 Ex -1.227818118 -1.304884466 0.077066348 2 1: GGA PBEJsJrLO 0 2 Ex -1.493773989 -1.416707671 0.077066317 2 1: GGA PBEJsJrLO 0 3 Ex -0.044551559 -0.124725122 0.080173562 2 1: GGA PBEJsJrLO 0 4 Ex 0.098214593 0.166190885 0.067976292 2 1: GGA PBEJsJrHEG 0 1 Ex -1.225568912 -1.290100592 0.064531681 2 1: GGA PBEJsJrHEG 0 2 Ex -1.506418756 -1.441887108 0.064531649 2 1: GGA PBEJsJrHEG 0 3 Ex -0.047046521 -0.116513462 0.069466941 2 1: GGA PBEJsJrHEG 0 4 Ex 0.103714775 0.159576394 0.055861619 2 1: GGA PBEGcGxLO 0 1 Ex -1.177545982 -1.246858864 0.069312882 2 1: GGA PBEGcGxLO 0 2 Ex -1.499840037 -1.430527186 0.069312851 2 1: GGA PBEGcGxLO 0 3 Ex -0.053989042 -0.124497106 0.070508064 2 1: GGA PBEGcGxLO 0 4 Ex 0.119019668 0.180882541 0.061862873 2 1: GGA PBEGcGxHEG 0 1 Ex -1.192219192 -1.250169385 0.057950194 2 1: GGA PBEGcGxHEG 0 2 Ex -1.510969833 -1.453019670 0.057950163 2 1: GGA PBEGcGxHEG 0 3 Ex -0.053395468 -0.114710577 0.061315109 2 1: GGA PBEGcGxHEG 0 4 Ex 0.117711124 0.168359510 0.050648386 2 1: GGA PBESOL 0 1 Ex -1.177545982 -1.246858864 0.069312882 2 1: GGA PBESOL 0 2 Ex -1.499840037 -1.430527186 0.069312851 2 1: GGA PBESOL 0 3 Ex -0.053989042 -0.124497106 0.070508064 2 1: GGA PBESOL 0 4 Ex 0.119019668 0.180882541 0.061862873 2 1: GGA AM05 0 1 Ex -0.864682178 -0.921996436 0.057314258 2 1: GGA AM05 0 1 Ec -0.120111406 -0.118083219 0.002028187 2 1: GGA AM05 0 2 Ex -1.489800922 -1.432486664 0.057314258 2 1: GGA AM05 0 2 Ec -0.067644278 -0.069672465 0.002028187 2 1: GGA AM05 0 3 Ex -0.104716676 -0.152527614 0.047810938 2 1: GGA AM05 0 3 Ec 0.008789023 0.011101267 0.002312244 2 1: GGA AM05 0 4 Ex 0.230849512 0.286762586 0.055913074 2 1: GGA AM05 0 4 Ec -0.019375536 -0.021072739 0.001697203 2 1: GGA PW86 0 1 Ex -1.187639388 -1.313380908 0.125741520 2 1: GGA PW86 0 2 Ex -1.429921461 -1.304179973 0.125741488 2 1: GGA PW86 0 3 Ex -0.040585846 -0.172218047 0.131632201 2 1: GGA PW86 0 4 Ex 0.089472119 0.200009919 0.110537801 2 1: GGA B88 0 1 Ex -0.953721128 -1.086631827 0.132910699 2 1: GGA B88 0 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0.016533064 2 1: GGA PW86 0 3 Ex 0.020279016 0.066422068 0.046143052 2 1: GGA PW86 0 4 Ex 0.008761537 -0.018783318 0.027544855 2 1: GGA B88 0 1 Ex -0.335029523 -0.339486959 0.004457436 2 1: GGA B88 0 2 Ex -0.420203037 -0.415745592 0.004457445 2 1: GGA B88 0 3 Ex 0.020561943 0.027067833 0.006505890 2 1: GGA B88 0 4 Ex 0.008883775 0.015193405 0.006309630 2 1: GGA C09 0 1 Ex -0.562092780 -0.607127826 0.045035046 2 1: GGA C09 0 2 Ex -0.383389114 -0.338354060 0.045035054 2 1: GGA C09 0 3 Ex -0.043141282 0.088692458 0.131833740 2 1: GGA C09 0 4 Ex -0.018639166 -0.107887477 0.089248311 2 1: GGA BH 0 1 Ex -0.420985838 -0.464163227 0.043177389 2 1: GGA BH 0 2 Ex -0.339394742 -0.296217344 0.043177398 2 1: GGA BH 0 3 Ex -0.019697103 0.104749071 0.124446174 2 1: GGA BH 0 4 Ex -0.008510122 -0.089564718 0.081054596 2 1: 1: iSpin dens gradDens 1: 1 0.383611676 -0.804873246 -1.212908822 1.149797724 1: 2 0.232638343 0.536955307 -2.950892849 2.804278684 1: 3 0.104307362 -1.283808214 -1.173097290 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0.118901172 2 1: GGA LYP 0 1 Ex -0.770306923 -0.658841122 0.111465801 2 1: GGA LYP 0 1 Ec -0.156072398 0.010239544 0.166311942 2 1: GGA LYP 0 2 Ex -0.650494169 -0.761959970 0.111465801 2 1: GGA LYP 0 2 Ec -0.296526713 -0.462838654 0.166311942 2 1: GGA LYP 0 3 Ex -0.082778541 0.055676348 0.138454889 2 1: GGA LYP 0 3 Ec 0.097039780 0.145525140 0.048485360 2 1: GGA LYP 0 4 Ex 0.149120094 0.270757665 0.121637571 2 1: GGA LYP 0 4 Ec -0.174810777 -0.081083011 0.093727766 2 1: GGA WC 0 1 Ex -0.882987707 -0.779495277 0.103492430 2 1: GGA WC 0 2 Ex -0.839124962 -0.942617387 0.103492425 2 1: GGA WC 0 3 Ex -0.030304737 0.027277922 0.057582660 2 1: GGA WC 0 4 Ex 0.054591990 0.128133135 0.073541145 2 1: GGA PBEJsJrLO 0 1 Ex -0.857722996 -0.748637566 0.109085429 2 1: GGA PBEJsJrLO 0 2 Ex -0.808188504 -0.917273929 0.109085425 2 1: GGA PBEJsJrLO 0 3 Ex -0.034223342 0.028603500 0.062826842 2 1: GGA PBEJsJrLO 0 4 Ex 0.061651099 0.140350248 0.078699149 2 1: GGA PBEJsJrHEG 0 1 Ex -0.875710260 -0.788300759 0.087409501 2 1: GGA PBEJsJrHEG 0 2 Ex -0.799746049 -0.887155546 0.087409496 2 1: GGA PBEJsJrHEG 0 3 Ex -0.052483616 -0.006832433 0.045651182 2 1: GGA PBEJsJrHEG 0 4 Ex 0.094545780 0.155002569 0.060456789 2 1: GGA PBEGcGxLO 0 1 Ex -0.846340358 -0.748914724 0.097425634 2 1: GGA PBEGcGxLO 0 2 Ex -0.787169975 -0.884595603 0.097425629 2 1: GGA PBEGcGxLO 0 3 Ex -0.040880773 0.019342485 0.060223257 2 1: GGA PBEGcGxLO 0 4 Ex 0.073644022 0.146213769 0.072569747 2 1: GGA PBEGcGxHEG 0 1 Ex -0.863443592 -0.782330047 0.081113545 2 1: GGA PBEGcGxHEG 0 2 Ex -0.784586575 -0.865700116 0.081113541 2 1: GGA PBEGcGxHEG 0 3 Ex -0.054482253 -0.010030770 0.044451483 2 1: GGA PBEGcGxHEG 0 4 Ex 0.098146194 0.155407725 0.057261532 2 1: GGA PBESOL 0 1 Ex -0.846340358 -0.748914724 0.097425634 2 1: GGA PBESOL 0 2 Ex -0.787169975 -0.884595603 0.097425629 2 1: GGA PBESOL 0 3 Ex -0.040880773 0.019342485 0.060223257 2 1: GGA PBESOL 0 4 Ex 0.073644022 0.146213769 0.072569747 2 1: GGA AM05 0 1 Ex -0.737658731 -0.685281159 0.052377572 2 1: GGA AM05 0 1 Ec -0.067345571 -0.068515767 0.001170197 2 1: GGA AM05 0 2 Ex -0.596485566 -0.648863137 0.052377571 2 1: GGA AM05 0 2 Ec -0.090712375 -0.089542179 0.001170197 2 1: GGA AM05 0 3 Ex -0.097536432 -0.013749012 0.083787420 2 1: GGA AM05 0 3 Ec 0.016144108 0.015602773 0.000541335 2 1: GGA AM05 0 4 Ex 0.175705464 0.243258741 0.067553277 2 1: GGA AM05 0 4 Ec -0.029082548 -0.029853156 0.000770608 2 1: GGA PW86 0 1 Ex -0.888191012 -0.781774351 0.106416661 2 1: GGA PW86 0 2 Ex -0.792054520 -0.898471176 0.106416655 2 1: GGA PW86 0 3 Ex -0.066420629 0.018057388 0.084478018 2 1: GGA PW86 0 4 Ex 0.119652393 0.209298264 0.089645871 2 1: GGA B88 0 1 Ex -0.769903876 -0.658486464 0.111417412 2 1: GGA B88 0 2 Ex -0.650236603 -0.761654010 0.111417406 2 1: GGA B88 0 3 Ex -0.082678028 0.055747476 0.138425504 2 1: GGA B88 0 4 Ex 0.148939026 0.270540827 0.121601801 2 1: GGA C09 0 1 Ex -0.808624496 -0.711182004 0.097442492 2 1: GGA C09 0 2 Ex -0.763062266 -0.860504753 0.097442487 2 1: GGA C09 0 3 Ex -0.031478910 0.057356018 0.088834928 2 1: GGA C09 0 4 Ex 0.056707185 0.145166422 0.088459238 2 1: GGA BH 0 1 Ex -0.774617319 -0.648359900 0.126257419 2 1: GGA BH 0 2 Ex -0.746053186 -0.872310600 0.126257414 2 1: GGA BH 0 3 Ex -0.019734938 0.071411138 0.091146075 2 1: GGA BH 0 4 Ex 0.035551191 0.136869268 0.101318077 2 1: 1: iSpin dens gradDens 1: 1 0.296042499 1.611686512 0.832493121 0.660976528 1: 2 0.345914880 0.865904321 -0.696519761 -1.203163443 1: 3 0.047086370 0.791969470 2.591820637 -0.017798357 1: 4 -0.045249970 0.665642096 -1.640315999 -2.404592960 1: GGA PW91 0 1 Ex -0.856860481 -1.562387003 0.705526522 2 1: GGA PW91 0 2 Ex -0.841449587 -0.135923061 0.705526527 2 1: GGA PW91 0 3 Ex 0.014549999 -0.166919569 0.181469568 2 1: GGA PW91 0 4 Ex -0.013982539 0.185982241 0.199964780 2 1: GGA PBE 0 1 Ex -0.872404526 -1.549130042 0.676725515 2 1: GGA PBE 0 2 Ex -0.847947052 -0.171221533 0.676725519 2 1: GGA PBE 0 3 Ex 0.023091212 -0.159836760 0.182927972 2 1: GGA PBE 0 4 Ex -0.022190639 0.160384994 0.182575634 2 1: GGA RPBE 0 1 Ex -0.869585478 -1.780315020 0.910729542 2 1: GGA RPBE 0 2 Ex -0.807421827 0.103307720 0.910729547 2 1: GGA RPBE 0 3 Ex 0.058691015 -0.191292395 0.249983410 2 1: GGA RPBE 0 4 Ex -0.056402026 0.185350923 0.241752950 2 1: GGA revPBE 0 1 Ex -0.800779113 -1.757662133 0.956883020 2 1: GGA revPBE 0 2 Ex -0.782307587 0.174575437 0.956883025 2 1: GGA revPBE 0 3 Ex 0.017439655 -0.216567163 0.234006817 2 1: GGA revPBE 0 4 Ex -0.016759496 0.267052522 0.283812019 2 1: GGA LYP 0 1 Ex -0.731369230 -1.671175095 0.939805865 2 1: GGA LYP 0 1 Ec -0.084917029 -0.035862462 0.049054566 2 1: GGA LYP 0 2 Ex -0.770055883 0.169749982 0.939805865 2 1: GGA LYP 0 2 Ec -0.074579521 -0.123634088 0.049054566 2 1: GGA LYP 0 3 Ex -0.036525509 -0.233284064 0.196758556 2 1: GGA LYP 0 3 Ec 0.009760025 -0.016097837 0.025857863 2 1: GGA LYP 0 4 Ex 0.035100989 0.348262119 0.313161130 2 1: GGA LYP 0 4 Ec -0.009379378 -0.063319456 0.053940078 2 1: GGA WC 0 1 Ex -0.799111288 -1.436311571 0.637200282 2 1: GGA WC 0 2 Ex -0.821401157 -0.184200870 0.637200286 2 1: GGA WC 0 3 Ex -0.021044694 -0.162777358 0.141732664 2 1: GGA WC 0 4 Ex 0.020223937 0.223885303 0.203661366 2 1: GGA PBEJsJrLO 0 1 Ex -0.816542005 -1.445604045 0.629062040 2 1: GGA PBEJsJrLO 0 2 Ex -0.816081185 -0.187019140 0.629062044 2 1: GGA PBEJsJrLO 0 3 Ex 0.000435078 -0.155828660 0.156263738 2 1: GGA PBEJsJrLO 0 4 Ex -0.000418109 0.183637668 0.184055778 2 1: GGA PBEJsJrHEG 0 1 Ex -0.857227113 -1.322090679 0.464863566 2 1: GGA PBEJsJrHEG 0 2 Ex -0.854161378 -0.389297809 0.464863570 2 1: GGA PBEJsJrHEG 0 3 Ex 0.002894474 -0.122874852 0.125769326 2 1: GGA PBEJsJrHEG 0 4 Ex -0.002781588 0.122520267 0.125301855 2 1: GGA PBEGcGxLO 0 1 Ex -0.793164916 -1.385387860 0.592222944 2 1: GGA PBEGcGxLO 0 2 Ex -0.805649486 -0.213426538 0.592222948 2 1: GGA PBEGcGxLO 0 3 Ex -0.011787146 -0.151839306 0.140052160 2 1: GGA PBEGcGxLO 0 4 Ex 0.011327440 0.191951561 0.180624121 2 1: GGA PBEGcGxHEG 0 1 Ex -0.834805688 -1.284314336 0.449508649 2 1: GGA PBEGcGxHEG 0 2 Ex -0.840625051 -0.391116399 0.449508652 2 1: GGA PBEGcGxHEG 0 3 Ex -0.005494277 -0.121748012 0.116253735 2 1: GGA PBEGcGxHEG 0 4 Ex 0.005279996 0.132021885 0.126741888 2 1: GGA PBESOL 0 1 Ex -0.793164916 -1.385387860 0.592222944 2 1: GGA PBESOL 0 2 Ex -0.805649486 -0.213426538 0.592222948 2 1: GGA PBESOL 0 3 Ex -0.011787146 -0.151839306 0.140052160 2 1: GGA PBESOL 0 4 Ex 0.011327440 0.191951561 0.180624121 2 1: GGA AM05 0 1 Ex -0.690078652 -1.221978768 0.531900116 2 1: GGA AM05 0 1 Ec -0.068942219 -0.061252036 0.007690183 2 1: GGA AM05 0 2 Ex -0.748677201 -0.216777085 0.531900116 2 1: GGA AM05 0 2 Ec -0.064607561 -0.072297744 0.007690183 2 1: GGA AM05 0 3 Ex -0.055325070 -0.152895883 0.097570813 2 1: GGA AM05 0 3 Ec 0.004092511 0.006710459 0.002617948 2 1: GGA AM05 0 4 Ex 0.053167355 0.244754382 0.191587027 2 1: GGA AM05 0 4 Ec -0.003932901 -0.005446586 0.001513685 2 1: GGA PW86 0 1 Ex -0.873625473 -1.556116860 0.682491387 2 1: GGA PW86 0 2 Ex -0.874197019 -0.191705627 0.682491392 2 1: GGA PW86 0 3 Ex -0.000539618 -0.171897727 0.171358109 2 1: GGA PW86 0 4 Ex 0.000518572 0.198311049 0.197792477 2 1: GGA B88 0 1 Ex -0.731048948 -1.670621843 0.939572895 2 1: GGA B88 0 2 Ex -0.769694507 0.169878393 0.939572900 2 1: GGA B88 0 3 Ex -0.036486710 -0.233189689 0.196702979 2 1: GGA B88 0 4 Ex 0.035063704 0.348154280 0.313090576 2 1: GGA C09 0 1 Ex -0.643244896 -1.461045421 0.817800524 2 1: GGA C09 0 2 Ex -0.716480157 0.101320372 0.817800529 2 1: GGA C09 0 3 Ex -0.069144134 -0.215891501 0.146747367 2 1: GGA C09 0 4 Ex 0.066447466 0.364415146 0.297967680 2 1: GGA BH 0 1 Ex -0.733611855 -1.542496438 0.808884583 2 1: GGA BH 0 2 Ex -0.741048970 0.067835618 0.808884588 2 1: GGA BH 0 3 Ex -0.007021656 -0.182514602 0.175492946 2 1: GGA BH 0 4 Ex 0.006747807 0.269889950 0.263142143 2 1: 1: iSpin dens gradDens 1: 1 0.572834672 -3.057999198 1.322871524 4.787972136 1: 2 0.576800664 3.455022845 0.880492663 -2.918554773 1: 3 0.003563364 -3.436434798 -0.363871274 -1.184296684 1: 4 -0.059044631 -3.892266145 0.943739001 4.178861672 1: GGA PW91 0 1 Ex -0.980479624 1.305271367 2.285750991 2 1: GGA PW91 0 2 Ex -0.979796955 -3.265547961 2.285751006 2 1: GGA PW91 0 3 Ex 0.000613365 0.827796683 0.827183318 2 1: GGA PW91 0 4 Ex -0.010163402 -0.037008924 0.026845523 2 1: GGA PBE 0 1 Ex -0.998019873 1.199847587 2.197867459 2 4/9 Test #7: libgridxc_test_libxc2 ............ Passed 0.19 sec 1: GGA PBE 0 2 Ex -0.995660141 -3.193527615 2.197867474 2 1: GGA PBE 0 3 Ex 0.002120172 0.814013228 0.811893056 2 1: GGA PBE 0 4 Ex -0.035131069 -0.059947820 0.024816751 2 1: GGA RPBE 0 1 Ex -0.930428859 2.101065229 3.031494088 2 1: GGA RPBE 0 2 Ex -0.927562664 -3.959056768 3.031494104 2 1: GGA RPBE 0 3 Ex 0.002575218 1.107272223 1.104697004 2 1: GGA RPBE 0 4 Ex -0.042671147 -0.077814175 0.035143028 2 1: GGA revPBE 0 1 Ex -0.913786092 2.084030981 2.997817073 2 1: GGA revPBE 0 2 Ex -0.913084918 -3.910902007 2.997817089 2 1: GGA revPBE 0 3 Ex 0.000629991 1.075831279 1.075201288 2 1: GGA revPBE 0 4 Ex -0.010438902 -0.046230976 0.035792073 2 1: GGA LYP 0 1 Ex -0.912168484 1.833584500 2.745752984 2 1: GGA LYP 0 1 Ec -0.078999707 -0.253521024 0.174521317 2 1: GGA LYP 0 2 Ex -0.914689306 -3.660442290 2.745752984 2 1: GGA LYP 0 2 Ec -0.077076407 0.097444911 0.174521317 2 1: GGA LYP 0 3 Ex -0.002264909 0.957883865 0.960148773 2 1: GGA LYP 0 3 Ec 0.001728047 -0.037215910 0.038943957 2 1: GGA LYP 0 4 Ex 0.037529343 0.003259392 0.034269951 2 1: GGA LYP 0 4 Ec -0.028633584 -0.025122621 0.003510963 2 1: GGA WC 0 1 Ex -0.951031753 1.040304751 1.991336504 2 1: GGA WC 0 2 Ex -0.954042068 -2.945378585 1.991336517 2 1: GGA WC 0 3 Ex -0.002704708 0.687569439 0.690274147 2 1: GGA WC 0 4 Ex 0.044816778 0.019596564 0.025220215 2 1: GGA PBEJsJrLO 0 1 Ex -0.959012474 1.022910366 1.981922840 2 1: GGA PBEJsJrLO 0 2 Ex -0.959027290 -2.940950144 1.981922854 2 1: GGA PBEJsJrLO 0 3 Ex -0.000013312 0.713876560 0.713889872 2 1: GGA PBEJsJrLO 0 4 Ex 0.000220577 -0.023258263 0.023478840 2 1: GGA PBEJsJrHEG 0 1 Ex -1.007994180 0.502270520 1.510264701 2 1: GGA PBEJsJrHEG 0 2 Ex -1.007098944 -2.517363658 1.510264714 2 1: GGA PBEJsJrHEG 0 3 Ex 0.000804352 0.558854714 0.558050362 2 1: GGA PBEJsJrHEG 0 4 Ex -0.013328043 -0.030371356 0.017043312 2 1: GGA PBEGcGxLO 0 1 Ex -0.946914497 0.886034268 1.832948765 2 1: GGA PBEGcGxLO 0 2 Ex -0.948029507 -2.780978286 1.832948778 2 1: GGA PBEGcGxLO 0 3 Ex -0.001001815 0.650634274 0.651636089 2 1: GGA PBEGcGxLO 0 4 Ex 0.016599982 -0.005632645 0.022232627 2 1: GGA PBEGcGxHEG 0 1 Ex -0.991295225 0.445552350 1.436847576 2 1: GGA PBEGcGxHEG 0 2 Ex -0.991322151 -2.428169739 1.436847589 2 1: GGA PBEGcGxHEG 0 3 Ex -0.000024192 0.523549095 0.523573286 2 1: GGA PBEGcGxHEG 0 4 Ex 0.000400854 -0.016257470 0.016658324 2 1: GGA PBESOL 0 1 Ex -0.946914497 0.886034268 1.832948765 2 1: GGA PBESOL 0 2 Ex -0.948029507 -2.780978286 1.832948778 2 1: GGA PBESOL 0 3 Ex -0.001001815 0.650634274 0.651636089 2 1: GGA PBESOL 0 4 Ex 0.016599982 -0.005632645 0.022232627 2 1: GGA AM05 0 1 Ex -0.887510909 0.594108916 1.481619826 2 1: GGA AM05 0 1 Ec -0.071683477 -0.097883093 0.026199616 2 1: GGA AM05 0 2 Ex -0.892016046 -2.373635871 1.481619825 2 1: GGA AM05 0 2 Ec -0.071560976 -0.045361361 0.026199616 2 1: GGA AM05 0 3 Ex -0.004047775 0.493382230 0.497430006 2 1: GGA AM05 0 3 Ec 0.000110065 -0.010607799 0.010717863 2 1: GGA AM05 0 4 Ex 0.067071286 0.047331616 0.019739670 2 1: GGA AM05 0 4 Ec -0.001823763 -0.001590684 0.000233079 2 1: GGA PW86 0 1 Ex -1.034439596 1.113123137 2.147562733 2 1: GGA PW86 0 2 Ex -1.032807987 -3.180370735 2.147562748 2 1: GGA PW86 0 3 Ex 0.001465968 0.792274505 0.790808537 2 1: GGA PW86 0 4 Ex -0.024290965 -0.048690708 0.024399743 2 1: GGA B88 0 1 Ex -0.911569802 1.833178757 2.744748558 2 1: GGA B88 0 2 Ex -0.914087828 -3.658836401 2.744748574 2 1: GGA B88 0 3 Ex -0.002262396 0.957529724 0.959792120 2 1: GGA B88 0 4 Ex 0.037487707 0.003229879 0.034257828 2 1: GGA C09 0 1 Ex -0.845362658 1.436393767 2.281756425 2 1: GGA C09 0 2 Ex -0.851424110 -3.133180548 2.281756438 2 1: GGA C09 0 3 Ex -0.005446093 0.758558244 0.764004337 2 1: GGA C09 0 4 Ex 0.090241291 0.059717060 0.030524231 2 1: GGA BH 0 1 Ex -0.802332442 1.895079946 2.697412388 2 1: GGA BH 0 2 Ex -0.809366488 -3.506778889 2.697412402 2 1: GGA BH 0 3 Ex -0.006319949 0.889484063 0.895804012 2 1: GGA BH 0 4 Ex 0.104721010 0.068191255 0.036529755 2 1: 1: iSpin dens gradDens 1: 1 0.099757078 -0.885542968 -0.502089013 -0.303761640 1: 2 0.080220371 0.057866621 0.431192037 0.463113575 1: 3 -0.003376142 0.055689019 0.341771181 -0.623713034 1: 4 -0.000539612 -0.842359725 0.821882968 -0.047496853 1: GGA PW91 0 1 Ex -0.703440605 -0.723822076 0.020381472 2 1: GGA PW91 0 2 Ex -0.557737841 -0.537356367 0.020381473 2 1: GGA PW91 0 3 Ex 0.025178923 -0.136362547 0.161541470 2 1: GGA PW91 0 4 Ex 0.004024373 0.645770580 0.641746207 2 1: GGA PBE 0 1 Ex -0.697711772 -0.716756862 0.019045090 2 1: GGA PBE 0 2 Ex -0.579909884 -0.560864792 0.019045092 2 1: GGA PBE 0 3 Ex 0.020357367 -0.121889766 0.142247133 2 1: GGA PBE 0 4 Ex 0.003253739 0.548474759 0.545221020 2 1: GGA RPBE 0 1 Ex -0.768332101 -0.790965427 0.022633326 2 1: GGA RPBE 0 2 Ex -0.568533367 -0.545900040 0.022633327 2 1: GGA RPBE 0 3 Ex 0.034527258 -0.161891062 0.196418320 2 1: GGA RPBE 0 4 Ex 0.005518527 0.824711300 0.819192773 2 1: GGA revPBE 0 1 Ex -0.652937926 -0.685578895 0.032640968 2 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GGA LYP 0 3 Ec -0.138286498 -0.049398960 0.088887538 2 1: GGA LYP 0 4 Ex 0.007655229 0.375012271 0.367357043 2 1: GGA LYP 0 4 Ec 0.056031339 0.213395108 0.157363769 2 1: GGA WC 0 1 Ex -0.593828489 -0.610380631 0.016552142 2 1: GGA WC 0 2 Ex -0.606743321 -0.590191197 0.016552124 2 1: GGA WC 0 3 Ex -0.025019736 -0.024520911 0.000498825 2 1: GGA WC 0 4 Ex 0.010137572 0.021911840 0.011774268 2 1: GGA PBEJsJrLO 0 1 Ex -0.572249848 -0.593666128 0.021416280 2 1: GGA PBEJsJrLO 0 2 Ex -0.586115126 -0.564698863 0.021416263 2 1: GGA PBEJsJrLO 0 3 Ex -0.026861024 -0.025477956 0.001383068 2 1: GGA PBEJsJrLO 0 4 Ex 0.010883630 0.027938584 0.017054954 2 1: GGA PBEJsJrHEG 0 1 Ex -0.527859469 -0.538896883 0.011037414 2 1: GGA PBEJsJrHEG 0 2 Ex -0.538138277 -0.527100878 0.011037399 2 1: GGA PBEJsJrHEG 0 3 Ex -0.019913001 -0.019489713 0.000423288 2 1: GGA PBEJsJrHEG 0 4 Ex 0.008068409 0.016143516 0.008075106 2 1: GGA PBEGcGxLO 0 1 Ex -0.555127304 -0.579801962 0.024674658 2 1: GGA PBEGcGxLO 0 2 Ex 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-1.237696953 -1.281044901 0.043347947 2 1: GGA BH 0 3 Ex 0.026768779 0.109760259 0.082991480 2 1: GGA BH 0 4 Ex -0.072134813 0.008528356 0.080663168 2 1: 1: iSpin dens gradDens 1: 1 1.781879109 -0.506383436 5.652748983 -11.658130100 1: 2 1.472172164 -5.138642884 -1.576436719 0.262379883 1: 3 0.298411814 2.027027385 -1.319662393 14.620918343 1: 4 -0.254392234 -4.674390739 14.185302206 -14.036203269 1: GGA PW91 0 1 Ex -1.483715395 -0.762834535 0.720880860 2 1: GGA PW91 0 2 Ex -1.482259039 -2.203139909 0.720880869 2 1: GGA PW91 0 3 Ex -0.001403242 -0.006843640 0.005440398 2 1: GGA PW91 0 4 Ex 0.001196246 0.433628495 0.432432249 2 1: GGA PBE 0 1 Ex -1.488085442 -0.799263948 0.688821494 2 1: GGA PBE 0 2 Ex -1.503841775 -2.192663277 0.688821502 2 1: GGA PBE 0 3 Ex 0.015181693 0.010321457 0.004860236 2 1: GGA PBE 0 4 Ex -0.012942198 0.400655448 0.413597646 2 1: GGA RPBE 0 1 Ex -1.496893269 -0.688930736 0.807962533 2 1: GGA RPBE 0 2 Ex -1.541953720 -2.349916261 0.807962541 2 1: GGA RPBE 0 3 Ex 0.043417079 0.037245351 0.006171728 2 1: GGA RPBE 0 4 Ex -0.037012501 0.447570165 0.484582666 2 1: GGA revPBE 0 1 Ex -1.439630002 -0.542275726 0.897354276 2 1: GGA revPBE 0 2 Ex -1.412761527 -2.310115812 0.897354285 2 1: GGA revPBE 0 3 Ex -0.025888572 -0.033740836 0.007852264 2 1: GGA revPBE 0 4 Ex 0.022069675 0.559095494 0.537025819 2 1: GGA LYP 0 1 Ex -1.387076861 -0.427619291 0.959457569 2 1: GGA LYP 0 1 Ec -0.087018457 -0.156538814 0.069520357 2 1: GGA LYP 0 2 Ex -1.273760239 -2.233217808 0.959457569 2 1: GGA LYP 0 2 Ec -0.135886304 -0.066365947 0.069520357 2 1: GGA LYP 0 3 Ex -0.109183921 -0.118496712 0.009312791 2 1: GGA LYP 0 3 Ec 0.047085617 0.048728220 0.001642602 2 1: GGA LYP 0 4 Ex 0.093077889 0.666194007 0.573116118 2 1: GGA LYP 0 4 Ec -0.040139883 -0.080531434 0.040391551 2 1: GGA WC 0 1 Ex -1.448898254 -0.781519634 0.667378620 2 1: GGA WC 0 2 Ex -1.381506182 -2.048884810 0.667378628 2 1: GGA WC 0 3 Ex -0.064934258 -0.070831123 0.005896866 2 1: GGA WC 0 4 Ex 0.055355619 0.454684569 0.399328949 2 1: GGA PBEJsJrLO 0 1 Ex -1.462485872 -0.867506675 0.594979197 2 1: GGA PBEJsJrLO 0 2 Ex -1.420932623 -2.015911829 0.594979206 2 1: GGA PBEJsJrLO 0 3 Ex -0.040037786 -0.045099930 0.005062144 2 1: GGA PBEJsJrLO 0 4 Ex 0.034131698 0.390368882 0.356237184 2 1: GGA PBEJsJrHEG 0 1 Ex -1.489898114 -1.016215884 0.473682230 2 1: GGA PBEJsJrHEG 0 2 Ex -1.471887769 -1.945570006 0.473682237 2 1: GGA PBEJsJrHEG 0 3 Ex -0.017353500 -0.020687971 0.003334471 2 1: GGA PBEJsJrHEG 0 4 Ex 0.014793636 0.299221633 0.284427997 2 1: GGA PBEGcGxLO 0 1 Ex -1.451168247 -0.903765631 0.547402616 2 1: GGA PBEGcGxLO 0 2 Ex -1.383278997 -1.930681621 0.547402625 2 1: GGA PBEGcGxLO 0 3 Ex -0.065413304 -0.070472994 0.005059691 2 1: GGA PBEGcGxLO 0 4 Ex 0.055764000 0.383043274 0.327279274 2 1: GGA PBEGcGxHEG 0 1 Ex -1.479815971 -1.042403288 0.437412684 2 1: GGA PBEGcGxHEG 0 2 Ex -1.439380199 -1.876792890 0.437412691 2 1: GGA PBEGcGxHEG 0 3 Ex -0.038961065 -0.042392970 0.003431906 2 1: GGA PBEGcGxHEG 0 4 Ex 0.033213806 0.295449537 0.262235731 2 1: GGA PBESOL 0 1 Ex -1.451168247 -0.903765631 0.547402616 2 1: GGA PBESOL 0 2 Ex -1.383278997 -1.930681621 0.547402625 2 1: GGA PBESOL 0 3 Ex -0.065413304 -0.070472994 0.005059691 2 1: GGA PBESOL 0 4 Ex 0.055764000 0.383043274 0.327279274 2 1: GGA AM05 0 1 Ex -1.395648701 -0.976023909 0.419624792 2 1: GGA AM05 0 1 Ec -0.083011770 -0.103392326 0.020380556 2 1: GGA AM05 0 2 Ex -1.223084211 -1.642709002 0.419624792 2 1: GGA AM05 0 2 Ec -0.086590028 -0.066209472 0.020380556 2 1: GGA AM05 0 3 Ex -0.166270998 -0.171995238 0.005724241 2 1: GGA AM05 0 3 Ec 0.003447758 0.003488404 0.000040647 2 1: GGA AM05 0 4 Ex 0.141743887 0.390462859 0.248718972 2 1: GGA AM05 0 4 Ec -0.002939169 -0.015297527 0.012358358 2 1: GGA PW86 0 1 Ex -1.433507314 -0.546729401 0.886777913 2 1: GGA PW86 0 2 Ex -1.456505815 -2.343283737 0.886777922 2 1: GGA PW86 0 3 Ex 0.022159736 0.016420852 0.005738884 2 1: GGA PW86 0 4 Ex -0.018890890 0.514175969 0.533066859 2 1: GGA B88 0 1 Ex -1.385252435 -0.426484025 0.958768410 2 1: GGA B88 0 2 Ex -1.272178793 -2.230947212 0.958768419 2 1: GGA B88 0 3 Ex -0.108949803 -0.118256761 0.009306958 2 1: GGA B88 0 4 Ex 0.092878306 0.665581685 0.572703379 2 1: GGA C09 0 1 Ex -1.346330152 -0.605137900 0.741192251 2 1: GGA C09 0 2 Ex -1.145719178 -1.886911438 0.741192260 2 1: GGA C09 0 3 Ex -0.193294616 -0.202341196 0.009046580 2 1: GGA C09 0 4 Ex 0.164781174 0.605347174 0.440566001 2 1: GGA BH 0 1 Ex -1.430601427 -0.780038056 0.650563372 2 1: GGA BH 0 2 Ex -1.331824816 -1.982388197 0.650563380 2 1: GGA BH 0 3 Ex -0.095174190 -0.102542841 0.007368651 2 1: GGA BH 0 4 Ex 0.081134773 0.468501494 0.387366721 2 1: 1: iSpin dens gradDens 1: 1 1.167612720 -5.633942374 -4.075018193 10.671491046 1: 2 1.174372670 3.831764723 -6.626652731 -4.634737870 1: 3 0.296375412 -5.560844869 -0.468778051 5.317140198 1: 4 -0.168695294 -10.826006393 7.803467660 9.858826117 1: GGA PW91 0 1 Ex -1.212132964 -0.935128064 0.277004900 2 1: GGA PW91 0 2 Ex -1.214385931 -1.491390825 0.277004894 2 1: GGA PW91 0 3 Ex -0.098776494 0.208333605 0.307110098 2 1: GGA PW91 0 4 Ex 0.056223050 0.590225016 0.534001966 2 1: GGA PBE 0 1 Ex -1.201084383 -0.923102677 0.277981706 2 1: GGA PBE 0 2 Ex -1.203270313 -1.481252013 0.277981699 2 1: GGA PBE 0 3 Ex -0.095837407 0.214646006 0.310483414 2 1: GGA PBE 0 4 Ex 0.054550138 0.594459004 0.539908866 2 1: GGA RPBE 0 1 Ex -1.182321900 -0.877753710 0.304568190 2 1: GGA RPBE 0 2 Ex -1.184374311 -1.488942494 0.304568183 2 1: GGA RPBE 0 3 Ex -0.089983501 0.254200080 0.344183581 2 1: GGA RPBE 0 4 Ex 0.051218126 0.649801061 0.598582936 2 1: GGA revPBE 0 1 Ex -1.187619102 -0.890682523 0.296936579 2 1: GGA revPBE 0 2 Ex -1.189708484 -1.486645057 0.296936572 2 1: GGA revPBE 0 3 Ex -0.091604473 0.242964883 0.334569357 2 1: GGA revPBE 0 4 Ex 0.052140775 0.633985690 0.581844916 2 1: GGA LYP 0 1 Ex -1.210504244 -0.929720756 0.280783488 2 1: GGA LYP 0 1 Ec -0.060402754 -0.085866625 0.025463871 2 1: GGA LYP 0 2 Ex -1.212742397 -1.493525885 0.280783488 2 1: GGA LYP 0 2 Ec -0.060174394 -0.034710523 0.025463871 2 1: GGA LYP 0 3 Ex -0.098126988 0.213918178 0.312045166 2 1: GGA LYP 0 3 Ec 0.010011962 0.000201202 0.009810760 2 1: GGA LYP 0 4 Ex 0.055853355 0.598449842 0.542596487 2 1: GGA LYP 0 4 Ec -0.005698755 -0.022424775 0.016726020 2 1: GGA WC 0 1 Ex -1.234618775 -1.013334875 0.221283899 2 1: GGA WC 0 2 Ex -1.236997662 -1.458281555 0.221283893 2 1: GGA WC 0 3 Ex -0.104297181 0.138309304 0.242606485 2 1: GGA WC 0 4 Ex 0.059365396 0.481159434 0.421794038 2 1: GGA PBEJsJrLO 0 1 Ex -1.221428761 -1.018399676 0.203029085 2 1: GGA PBEJsJrLO 0 2 Ex -1.223670422 -1.426699501 0.203029079 2 1: GGA PBEJsJrLO 0 3 Ex -0.098280782 0.130221603 0.228502385 2 1: GGA PBEJsJrLO 0 4 Ex 0.055940893 0.453321637 0.397380744 2 1: GGA PBEJsJrHEG 0 1 Ex -1.229594036 -1.038099121 0.191494914 2 1: GGA PBEJsJrHEG 0 2 Ex -1.231894034 -1.423388942 0.191494908 2 1: GGA PBEJsJrHEG 0 3 Ex -0.100838461 0.113025452 0.213863913 2 1: GGA PBEJsJrHEG 0 4 Ex 0.057396711 0.429290685 0.371893974 2 1: GGA PBEGcGxLO 0 1 Ex -1.231585234 -1.061923664 0.169661571 2 1: GGA PBEGcGxLO 0 2 Ex -1.233862160 -1.403523724 0.169661564 2 1: GGA PBEGcGxLO 0 3 Ex -0.099826891 0.091757913 0.191584804 2 1: GGA PBEGcGxLO 0 4 Ex 0.056820931 0.390010898 0.333189967 2 1: GGA PBEGcGxHEG 0 1 Ex -1.237381142 -1.075729110 0.161652032 2 1: GGA PBEGcGxHEG 0 2 Ex -1.239700404 -1.401352430 0.161652026 2 1: GGA PBEGcGxHEG 0 3 Ex -0.101683051 0.079656908 0.181339960 2 1: GGA PBEGcGxHEG 0 4 Ex 0.057877447 0.373229050 0.315351603 2 1: GGA PBESOL 0 1 Ex -1.231585234 -1.061923664 0.169661571 2 1: GGA PBESOL 0 2 Ex -1.233862160 -1.403523724 0.169661564 2 1: GGA PBESOL 0 3 Ex -0.099826891 0.091757913 0.191584804 2 1: GGA PBESOL 0 4 Ex 0.056820931 0.390010898 0.333189967 2 1: GGA AM05 0 1 Ex -1.258855234 -1.208631177 0.050224057 2 1: GGA AM05 0 1 Ec -0.088942114 -0.106284113 0.017341999 2 1: GGA AM05 0 2 Ex -1.261178709 -1.311402765 0.050224057 2 1: GGA AM05 0 2 Ec -0.088657305 -0.071315306 0.017341999 2 1: GGA AM05 0 3 Ex -0.101867734 -0.039046668 0.062821066 2 1: GGA AM05 0 3 Ec 0.012486854 -0.004339754 0.016826608 2 1: GGA AM05 0 4 Ex 0.057982568 0.167344619 0.109362051 2 1: GGA AM05 0 4 Ec -0.007107450 -0.036322120 0.029214669 2 1: GGA PW86 0 1 Ex -1.157749730 -0.774068024 0.383681706 2 1: GGA PW86 0 2 Ex -1.159970131 -1.543651829 0.383681699 2 1: GGA PW86 0 3 Ex -0.097348690 0.321563500 0.418912190 2 1: GGA PW86 0 4 Ex 0.055410352 0.783696495 0.728286144 2 1: GGA B88 0 1 Ex -1.209344075 -0.928679491 0.280664584 2 1: GGA B88 0 2 Ex -1.211575511 -1.492240088 0.280664577 2 1: GGA B88 0 3 Ex -0.097832472 0.214054777 0.311887250 2 1: GGA B88 0 4 Ex 0.055685718 0.598007184 0.542321466 2 1: GGA C09 0 1 Ex -1.238924083 -1.101890331 0.137033751 2 1: GGA C09 0 2 Ex -1.241207625 -1.378241370 0.137033745 2 1: GGA C09 0 3 Ex -0.100116980 0.056521980 0.156638960 2 1: GGA C09 0 4 Ex 0.056986048 0.329434500 0.272448452 2 1: GGA BH 0 1 Ex -1.235044147 -1.091210104 0.143834043 2 1: GGA BH 0 2 Ex -1.237300676 -1.381134713 0.143834037 2 1: GGA BH 0 3 Ex -0.098932647 0.066053327 0.164985975 2 1: GGA BH 0 4 Ex 0.056311932 0.343288740 0.286976808 2 1: 1: iSpin dens gradDens 1: 1 0.000083938 0.000828537 -0.001037074 0.000894185 1: 2 0.000148202 0.000960688 -0.000105342 0.000488157 1: 3 -0.000005072 0.000060124 0.000134669 0.000380396 1: 4 0.000086558 0.000375984 0.000100667 -0.000861889 1: GGA PW91 0 1 Ex -0.029955770 -0.023405834 0.006549936 2 1: GGA PW91 0 2 Ex -0.061797037 -0.068346973 0.006549937 2 1: GGA PW91 0 3 Ex 0.002512837 0.002091508 0.000421329 2 1: GGA PW91 0 4 Ex -0.042887713 -0.040480953 0.002406761 2 1: GGA PBE 0 1 Ex -0.085467132 -0.085707618 0.000240486 2 1: GGA PBE 0 2 Ex -0.108118618 -0.107878138 0.000240481 2 1: GGA PBE 0 3 Ex 0.001787602 0.001803339 0.000015737 2 1: GGA PBE 0 4 Ex -0.030509794 -0.030598139 0.000088345 2 1: GGA revPBE 0 1 Ex -0.105145190 -0.105709960 0.000564769 2 1: GGA revPBE 0 2 Ex -0.132043057 -0.131478295 0.000564763 2 1: GGA revPBE 0 3 Ex 0.002122716 0.002159382 0.000036666 2 1: GGA revPBE 0 4 Ex -0.036229338 -0.036436835 0.000207497 2 1: GGA LYP 0 1 Ex -0.213276602 -0.228567270 0.015290668 2 1: GGA LYP 0 1 Ec -0.098791568 -0.132198858 0.033407290 2 1: GGA LYP 0 2 Ex -0.155121399 -0.139830730 0.015290668 2 1: GGA LYP 0 2 Ec -0.057514798 -0.024107508 0.033407290 2 1: GGA LYP 0 3 Ex -0.004589471 0.019123040 0.023712511 2 1: GGA LYP 0 3 Ec -0.003257465 -0.031128957 0.027871493 2 1: GGA LYP 0 4 Ex 0.078330543 0.074043733 0.004286809 2 1: GGA LYP 0 4 Ec 0.055596603 0.041562241 0.014034363 2 1: GGA WC 0 1 Ex -0.085145542 -0.085441273 0.000295731 2 1: GGA WC 0 2 Ex -0.107456592 -0.107160867 0.000295725 2 1: GGA WC 0 3 Ex 0.001760735 0.001780038 0.000019302 2 1: GGA WC 0 4 Ex -0.030051252 -0.030159896 0.000108644 2 1: GGA PBEJsJrLO 0 1 Ex -0.084997371 -0.085340285 0.000342913 2 1: GGA PBEJsJrLO 0 2 Ex -0.107149737 -0.106806829 0.000342908 2 1: GGA PBEJsJrLO 0 3 Ex 0.001748212 0.001770540 0.000022328 2 1: GGA PBEJsJrLO 0 4 Ex -0.029837516 -0.029963498 0.000125982 2 1: GGA PBEJsJrHEG 0 1 Ex -0.073721011 -0.073885470 0.000164459 2 1: GGA PBEJsJrHEG 0 2 Ex -0.093413138 -0.093248684 0.000164454 2 1: GGA PBEJsJrHEG 0 3 Ex 0.001554056 0.001564865 0.000010809 2 1: GGA PBEJsJrHEG 0 4 Ex -0.026523766 -0.026584178 0.000060412 2 1: GGA PBEGcGxLO 0 1 Ex -0.084664165 -0.085079348 0.000415184 2 1: GGA PBEGcGxLO 0 2 Ex -0.106462519 -0.106047341 0.000415178 2 1: GGA PBEGcGxLO 0 3 Ex 0.001720274 0.001747252 0.000026978 2 1: GGA PBEGcGxLO 0 4 Ex -0.029360690 -0.029513228 0.000152537 2 1: GGA PBEGcGxHEG 0 1 Ex -0.073558838 -0.073758713 0.000199875 2 1: GGA PBEGcGxHEG 0 2 Ex -0.093078652 -0.092878782 0.000199870 2 1: GGA PBEGcGxHEG 0 3 Ex 0.001540457 0.001553545 0.000013087 2 1: GGA PBEGcGxHEG 0 4 Ex -0.026291674 -0.026365100 0.000073426 2 1: GGA PBESOL 0 1 Ex -0.084664165 -0.085079348 0.000415184 2 1: GGA PBESOL 0 2 Ex -0.106462519 -0.106047341 0.000415178 2 1: GGA PBESOL 0 3 Ex 0.001720274 0.001747252 0.000026978 2 1: GGA PBESOL 0 4 Ex -0.029360690 -0.029513228 0.000152537 2 1: GGA AM05 0 1 Ex -0.179356368 -0.190359678 0.011003310 2 5/9 Test #5: libgridxc_test6 .................. Passed 0.22 sec 1: GGA AM05 0 1 Ec -0.025712431 -0.025710986 0.000001445 2 1: GGA AM05 0 2 Ex -0.129558815 -0.118555505 0.011003310 2 1: GGA AM05 0 2 Ec -0.018386726 -0.018388172 0.000001445 2 1: GGA AM05 0 3 Ex -0.003929905 0.009616421 0.013546326 2 1: GGA AM05 0 4 Ex 0.067073437 0.063782519 0.003290918 2 1: GGA PW86 0 1 Ex -0.175012658 -0.181988782 0.006976124 2 1: GGA PW86 0 2 Ex -0.147884492 -0.140908394 0.006976098 2 1: GGA PW86 0 3 Ex -0.002140890 -0.000005972 0.002134918 2 1: GGA PW86 0 4 Ex 0.036539533 0.034074974 0.002464559 2 1: GGA B88 0 1 Ex -0.213276281 -0.228567002 0.015290721 2 1: GGA B88 0 2 Ex -0.155121240 -0.139830674 0.015290565 2 1: GGA B88 0 3 Ex -0.004589458 0.019124638 0.023714096 2 1: GGA B88 0 4 Ex 0.078330324 0.074043597 0.004286727 2 1: GGA C09 0 1 Ex -0.105062056 -0.105851824 0.000789769 2 1: GGA C09 0 2 Ex -0.131864937 -0.131075175 0.000789762 2 1: GGA C09 0 3 Ex 0.002115220 0.002166296 0.000051077 2 1: GGA C09 0 4 Ex -0.036101400 -0.036391576 0.000290176 2 1: GGA BH 0 1 Ex -0.173762478 -0.180457452 0.006694974 2 1: GGA BH 0 2 Ex -0.148177386 -0.141482437 0.006694949 2 1: GGA BH 0 3 Ex -0.002019115 0.000074766 0.002093880 2 1: GGA BH 0 4 Ex 0.034461133 0.032098537 0.002362596 2 1: 1: iSpin dens gradDens 1: 1 0.999922139 -6.208203198 -2.393033938 -6.648105388 1: 2 0.921699347 3.168903510 2.536823438 -9.341322520 1: 3 -0.074937860 6.861867849 -0.547015199 6.922790843 1: 4 0.189782874 9.340328476 -9.142062683 0.471506346 1: GGA PW91 0 1 Ex -1.193969372 -0.940868842 0.253100530 2 1: GGA PW91 0 2 Ex -1.193950668 -1.447051192 0.253100524 2 1: GGA PW91 0 3 Ex 0.000017918 -0.561836775 0.561854694 2 1: GGA PW91 0 4 Ex -0.000045379 -0.274060143 0.274014763 2 1: GGA PBE 0 1 Ex -1.213872997 -0.972686022 0.241186976 2 1: GGA PBE 0 2 Ex -1.222245620 -1.463432589 0.241186969 2 1: GGA PBE 0 3 Ex -0.008021018 -0.497441672 0.489420654 2 1: GGA PBE 0 4 Ex 0.020313521 -0.222644659 0.242958180 2 1: GGA RPBE 0 1 Ex -1.143569180 -0.809568985 0.334000194 2 1: GGA RPBE 0 2 Ex -1.171727153 -1.505727340 0.334000187 2 1: GGA RPBE 0 3 Ex -0.026975491 -0.707026431 0.680050940 2 1: GGA RPBE 0 4 Ex 0.068316420 -0.269041640 0.337358060 2 1: GGA revPBE 0 1 Ex -1.109965876 -0.771926717 0.338039159 2 1: GGA revPBE 0 2 Ex -1.113408337 -1.451447488 0.338039151 2 1: GGA revPBE 0 3 Ex -0.003297896 -0.791659417 0.788361520 2 1: GGA revPBE 0 4 Ex 0.008352044 -0.372606013 0.380958057 2 1: GGA LYP 0 1 Ex -1.092973188 -0.774211066 0.318762123 2 1: GGA LYP 0 1 Ec -0.094359624 -0.100372367 0.006012743 2 1: GGA LYP 0 2 Ex -1.063191445 -1.381953567 0.318762122 2 1: GGA LYP 0 2 Ec -0.104723604 -0.098710861 0.006012743 2 1: GGA LYP 0 3 Ex 0.028531072 -0.837800833 0.866331905 2 1: GGA LYP 0 3 Ec -0.009928750 0.147628534 0.157557283 2 1: GGA LYP 0 4 Ex -0.072255984 -0.480028765 0.407772781 2 1: GGA LYP 0 4 Ec 0.025144922 0.088597288 0.063452366 2 1: GGA WC 0 1 Ex -1.153200654 -0.927080808 0.226119846 2 1: GGA WC 0 2 Ex -1.128670456 -1.354790296 0.226119840 2 1: GGA WC 0 3 Ex 0.023500063 -0.573260068 0.596760131 2 1: GGA WC 0 4 Ex -0.059514770 -0.341752015 0.282237245 2 1: GGA PBEJsJrLO 0 1 Ex -1.160321704 -0.937695972 0.222625732 2 1: GGA PBEJsJrLO 0 2 Ex -1.153368712 -1.375994438 0.222625726 2 1: GGA PBEJsJrLO 0 3 Ex 0.006661004 -0.502486436 0.509147440 2 1: GGA PBEJsJrLO 0 4 Ex -0.016869237 -0.263791562 0.246922325 2 1: GGA PBEJsJrHEG 0 1 Ex -1.220558453 -1.054871945 0.165686508 2 1: GGA PBEJsJrHEG 0 2 Ex -1.215936883 -1.381623386 0.165686503 2 1: GGA PBEJsJrHEG 0 3 Ex 0.004427490 -0.331320347 0.335747837 2 1: GGA PBEJsJrHEG 0 4 Ex -0.011212779 -0.177932042 0.166719262 2 1: GGA PBEGcGxLO 0 1 Ex -1.142430548 -0.934099935 0.208330613 2 1: GGA PBEGcGxLO 0 2 Ex -1.127369601 -1.335700208 0.208330607 2 1: GGA PBEGcGxLO 0 3 Ex 0.014428469 -0.491074056 0.505502525 2 1: GGA PBEGcGxLO 0 4 Ex -0.036540626 -0.279077707 0.242537082 2 1: GGA PBEGcGxHEG 0 1 Ex -1.197934904 -1.038224370 0.159710534 2 1: GGA PBEGcGxHEG 0 2 Ex -1.187608192 -1.347318721 0.159710529 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-1.171197782 -1.324034893 0.152837111 2 1: GGA LYP 0 1 Ec -0.167608847 -0.192753644 0.025144797 2 1: GGA LYP 0 2 Ex -1.616540097 -1.463702986 0.152837111 2 1: GGA LYP 0 2 Ec -0.055978309 -0.030833513 0.025144797 2 1: GGA LYP 0 3 Ex -0.153000762 -0.309194684 0.156193922 2 1: GGA LYP 0 3 Ec 0.038351526 0.003516515 0.034835011 2 1: GGA LYP 0 4 Ex -0.027522011 -0.395759171 0.368237160 2 1: GGA LYP 0 4 Ec 0.006898731 -0.002883904 0.009782635 2 1: GGA WC 0 1 Ex -1.590247274 -1.686237878 0.095990604 2 1: GGA WC 0 2 Ex -1.699981583 -1.603990984 0.095990599 2 1: GGA WC 0 3 Ex -0.037700062 -0.143671292 0.105971230 2 1: GGA WC 0 4 Ex -0.006781545 -0.194291698 0.187510153 2 1: GGA PBEJsJrLO 0 1 Ex -1.538447106 -1.637994934 0.099547828 2 1: GGA PBEJsJrLO 0 2 Ex -1.663231424 -1.563683601 0.099547823 2 1: GGA PBEJsJrLO 0 3 Ex -0.042870608 -0.152792405 0.109921797 2 1: GGA PBEJsJrLO 0 4 Ex -0.007711631 -0.202040013 0.194328382 2 1: GGA PBEJsJrHEG 0 1 Ex -1.527784231 -1.614366242 0.086582012 2 1: GGA PBEJsJrHEG 0 2 Ex -1.678586236 -1.592004228 0.086582007 2 1: GGA PBEJsJrHEG 0 3 Ex -0.051809183 -0.149540740 0.097731557 2 1: GGA PBEJsJrHEG 0 4 Ex -0.009319515 -0.166514089 0.157194574 2 1: GGA PBEGcGxLO 0 1 Ex -1.472654874 -1.559867715 0.087212841 2 1: GGA PBEGcGxLO 0 2 Ex -1.671001322 -1.583788486 0.087212836 2 1: GGA PBEGcGxLO 0 3 Ex -0.068143441 -0.162962923 0.094819482 2 1: GGA PBEGcGxLO 0 4 Ex -0.012257746 -0.190744994 0.178487248 2 1: GGA PBEGcGxHEG 0 1 Ex -1.484804696 -1.561112455 0.076307758 2 1: GGA PBEGcGxHEG 0 2 Ex -1.684050785 -1.607743032 0.076307753 2 1: GGA PBEGcGxHEG 0 3 Ex -0.068452519 -0.153655108 0.085202588 2 1: GGA PBEGcGxHEG 0 4 Ex -0.012313344 -0.156033682 0.143720338 2 1: GGA PBESOL 0 1 Ex -1.472654874 -1.559867715 0.087212841 2 1: GGA PBESOL 0 2 Ex -1.671001322 -1.583788486 0.087212836 2 1: GGA PBESOL 0 3 Ex -0.068143441 -0.162962923 0.094819482 2 1: GGA PBESOL 0 4 Ex -0.012257746 -0.190744994 0.178487248 2 1: GGA AM05 0 1 Ex -1.048823168 -1.106764191 0.057941024 2 1: GGA AM05 0 1 Ec -0.109294137 -0.106521108 0.002773029 2 1: GGA AM05 0 2 Ex -1.661418770 -1.603477746 0.057941024 2 1: GGA AM05 0 2 Ec -0.071684259 -0.074457287 0.002773029 2 1: GGA AM05 0 3 Ex -0.210461910 -0.263012573 0.052550664 2 1: GGA AM05 0 3 Ec 0.012921162 0.016158653 0.003237491 2 1: GGA AM05 0 4 Ex -0.037858210 -0.214498762 0.176640552 2 1: GGA AM05 0 4 Ec 0.002324278 0.006761999 0.004437721 2 1: GGA PW86 0 1 Ex -1.479432197 -1.640125052 0.160692856 2 1: GGA PW86 0 2 Ex -1.597910174 -1.437217324 0.160692850 2 1: GGA PW86 0 3 Ex -0.040704016 -0.218236158 0.177532141 2 1: GGA PW86 0 4 Ex -0.007321901 -0.320493339 0.313171438 2 1: GGA B88 0 1 Ex -1.169881626 -1.322570227 0.152688601 2 1: GGA B88 0 2 Ex -1.613663551 -1.460974955 0.152688596 2 1: GGA B88 0 3 Ex -0.152464678 -0.308495860 0.156031181 2 1: GGA B88 0 4 Ex -0.027425580 -0.395365784 0.367940204 2 1: GGA C09 0 1 Ex -1.176618457 -1.271947971 0.095329514 2 1: GGA C09 0 2 Ex -1.648729591 -1.553400081 0.095329510 2 1: GGA C09 0 3 Ex -0.162197395 -0.254750188 0.092552793 2 1: GGA C09 0 4 Ex -0.029176316 -0.285933794 0.256757479 2 1: GGA BH 0 1 Ex -1.521397808 -1.607450529 0.086052722 2 1: GGA BH 0 2 Ex -1.674921192 -1.588868476 0.086052717 2 1: GGA BH 0 3 Ex -0.052744134 -0.142898040 0.090153906 2 1: GGA BH 0 4 Ex -0.009487696 -0.204525756 0.195038060 2 1: 1: iSpin dens gradDens 1: 1 1.225777286 -7.926101264 -4.889391476 -3.710789783 1: 2 0.847778000 3.399579215 -5.377072118 -0.058893307 1: 3 -0.047191304 -0.920614353 -1.189034320 -10.242416313 1: 4 -0.086279320 0.556963513 -3.402629231 -2.351910462 1: GGA PW91 0 1 Ex -1.232422637 -1.194632773 0.037789864 2 1: GGA PW91 0 2 Ex -1.071715774 -1.109505652 0.037789878 2 1: GGA PW91 0 3 Ex 0.020063441 0.151884122 0.131820681 2 1: GGA PW91 0 4 Ex 0.036681759 0.047362050 0.010680291 2 1: GGA PBE 0 1 Ex -1.218734489 -1.184479452 0.034255037 2 1: GGA PBE 0 2 Ex -1.070334838 -1.104589888 0.034255050 2 1: GGA PBE 0 3 Ex 0.018526948 0.145433726 0.126906778 2 1: GGA PBE 0 4 Ex 0.033872606 0.039497368 0.005624762 2 1: GGA RPBE 0 1 Ex -1.188137074 -1.113049514 0.075087560 2 1: GGA RPBE 0 2 Ex -0.976631494 -1.051719067 0.075087573 2 1: GGA RPBE 0 3 Ex 0.026405405 0.240639536 0.214234131 2 1: GGA RPBE 0 4 Ex 0.048276699 0.095582836 0.047306138 2 1: GGA revPBE 0 1 Ex -1.196170112 -1.128450467 0.067719646 2 1: GGA revPBE 0 2 Ex -0.994076482 -1.061796140 0.067719659 2 1: GGA revPBE 0 3 Ex 0.025230370 0.222804906 0.197574535 2 1: GGA revPBE 0 4 Ex 0.046128397 0.086406837 0.040278440 2 1: GGA LYP 0 1 Ex -1.227997259 -1.176780970 0.051216289 2 1: GGA LYP 0 1 Ec -0.053344275 -0.078852949 0.025508674 2 1: GGA LYP 0 2 Ex -1.042841402 -1.094057691 0.051216289 2 1: GGA LYP 0 2 Ec -0.100026431 -0.074517757 0.025508674 2 1: GGA LYP 0 3 Ex 0.023115775 0.182096148 0.158980373 2 1: GGA LYP 0 3 Ec -0.005828032 -0.051318636 0.045490605 2 1: GGA LYP 0 4 Ex 0.042262306 0.067498589 0.025236283 2 1: GGA LYP 0 4 Ec -0.010655323 -0.041651967 0.030996643 2 1: GGA WC 0 1 Ex -1.260637989 -1.227015572 0.033622417 2 1: GGA WC 0 2 Ex -1.087507037 -1.121129467 0.033622430 2 1: GGA WC 0 3 Ex 0.021614526 0.131468067 0.109853541 2 1: GGA WC 0 4 Ex 0.039517590 0.053083991 0.013566401 2 1: GGA PBEJsJrLO 0 1 Ex -1.238431632 -1.195224537 0.043207095 2 1: GGA PBEJsJrLO 0 2 Ex -1.057183870 -1.100390978 0.043207108 2 1: GGA PBEJsJrLO 0 3 Ex 0.022627869 0.151574943 0.128947074 2 1: GGA PBEJsJrLO 0 4 Ex 0.041370273 0.065489051 0.024118778 2 1: GGA PBEJsJrHEG 0 1 Ex -1.252034697 -1.228628679 0.023406017 2 1: GGA PBEJsJrHEG 0 2 Ex -1.102389376 -1.125795407 0.023406030 2 1: GGA PBEJsJrHEG 0 3 Ex 0.018682463 0.105722070 0.087039606 2 1: GGA PBEJsJrHEG 0 4 Ex 0.034156933 0.037822041 0.003665107 2 1: GGA PBEGcGxLO 0 1 Ex -1.249287762 -1.205265433 0.044022328 2 1: GGA PBEGcGxLO 0 2 Ex -1.058576675 -1.102599017 0.044022341 2 1: GGA PBEGcGxLO 0 3 Ex 0.023809317 0.147256095 0.123446778 2 1: GGA PBEGcGxLO 0 4 Ex 0.043530301 0.072443332 0.028913030 2 1: GGA PBEGcGxHEG 0 1 Ex -1.259302645 -1.231552382 0.027750263 2 1: GGA PBEGcGxHEG 0 2 Ex -1.095343302 -1.123093578 0.027750276 2 1: GGA PBEGcGxHEG 0 3 Ex 0.020469497 0.109908380 0.089438883 2 1: GGA PBEGcGxHEG 0 4 Ex 0.037424146 0.049293256 0.011869110 2 1: GGA PBESOL 0 1 Ex -1.249287762 -1.205265433 0.044022328 2 1: GGA PBESOL 0 2 Ex -1.058576675 -1.102599017 0.044022341 2 1: GGA PBESOL 0 3 Ex 0.023809317 0.147256095 0.123446778 2 1: GGA PBESOL 0 4 Ex 0.043530301 0.072443332 0.028913030 2 1: GGA AM05 0 1 Ex -1.273496318 -1.218126324 0.055369994 2 1: GGA AM05 0 1 Ec -0.077031174 -0.074538777 0.002492397 2 1: GGA AM05 0 2 Ex -1.039510715 -1.094880708 0.055369993 2 1: GGA AM05 0 2 Ec -0.086802765 -0.089295162 0.002492397 2 1: GGA AM05 0 3 Ex 0.029211922 0.151671143 0.122459221 2 1: GGA AM05 0 3 Ec -0.001219934 0.001377831 0.002597765 2 1: GGA AM05 0 4 Ex 0.053407822 0.107718620 0.054310797 2 1: GGA AM05 0 4 Ec -0.002230391 0.001808471 0.004038862 2 1: GGA PW86 0 1 Ex -1.189542905 -1.197183396 0.007640491 2 1: GGA PW86 0 2 Ex -1.128743098 -1.121102619 0.007640478 2 1: GGA PW86 0 3 Ex 0.007590549 0.069824966 0.062234416 2 1: GGA PW86 0 4 Ex 0.013877714 -0.036898834 0.050776548 2 1: GGA B88 0 1 Ex -1.226777416 -1.175567141 0.051210275 2 1: GGA B88 0 2 Ex -1.041977530 -1.093187818 0.051210288 2 1: GGA B88 0 3 Ex 0.023071334 0.182003174 0.158931840 2 1: GGA B88 0 4 Ex 0.042181055 0.067430791 0.025249737 2 1: GGA C09 0 1 Ex -1.252958532 -1.187104956 0.065853577 2 1: GGA C09 0 2 Ex -1.014054890 -1.079908479 0.065853589 2 1: GGA C09 0 3 Ex 0.029825915 0.189182643 0.159356728 2 1: GGA C09 0 4 Ex 0.054530378 0.111624675 0.057094297 2 1: GGA BH 0 1 Ex -1.245069460 -1.158715824 0.086353637 2 1: GGA BH 0 2 Ex -0.968694224 -1.055047873 0.086353649 2 1: GGA BH 0 3 Ex 0.034504054 0.235311342 0.200807288 2 1: GGA BH 0 4 Ex 0.063083366 0.142412401 0.079329034 2 1: 1: iSpin dens gradDens 1: 1 0.126905828 -1.179818041 1.124184760 -0.549755670 1: 2 0.141066732 -0.132074232 -0.064680842 0.252334838 1: 3 0.033693414 -0.397932018 -0.729076709 -1.265871057 1: 4 0.024686256 0.254253135 0.562060970 -1.030644410 1: GGA PW91 0 1 Ex -1.067815746 -1.274548830 0.206733084 2 1: GGA PW91 0 2 Ex -0.975206150 -0.768473077 0.206733073 2 1: GGA PW91 0 3 Ex 0.220348478 0.219540551 0.000807927 2 1: GGA PW91 0 4 Ex 0.161443386 0.103251481 0.058191905 2 1: GGA PBE 0 1 Ex -0.829323942 -1.026582542 0.197258600 2 1: GGA PBE 0 2 Ex -0.812869957 -0.615611368 0.197258589 2 1: GGA PBE 0 3 Ex 0.039149403 0.004563917 0.034585486 2 1: GGA PBE 0 4 Ex 0.028683712 0.019311074 0.009372638 2 1: GGA RPBE 0 1 Ex -0.909670663 -1.176166305 0.266495642 2 1: GGA RPBE 0 2 Ex -0.870876228 -0.604380598 0.266495630 2 1: GGA RPBE 0 3 Ex 0.092304634 0.053125744 0.039178890 2 1: GGA RPBE 0 4 Ex 0.067629115 0.044667459 0.022961656 2 1: GGA revPBE 0 1 Ex -0.847778405 -1.170815547 0.323037143 2 1: GGA revPBE 0 2 Ex -0.805216958 -0.482179828 0.323037130 2 1: GGA revPBE 0 3 Ex 0.101267582 0.041819110 0.059448472 2 1: GGA revPBE 0 4 Ex 0.074196026 0.062682525 0.011513501 2 1: GGA LYP 0 1 Ex -0.588273689 -0.970845792 0.382572103 2 1: GGA LYP 0 1 Ec -0.129346649 -0.270167474 0.140820825 2 1: GGA LYP 0 2 Ex -0.596346787 -0.213774684 0.382572103 2 1: GGA LYP 0 2 Ec -0.125934017 0.014886808 0.140820825 2 1: GGA LYP 0 3 Ex -0.019208537 -0.125252357 0.106043820 2 1: GGA LYP 0 3 Ec 0.008119766 0.021216928 0.013097162 2 1: GGA LYP 0 4 Ex -0.014073577 0.020933557 0.035007134 2 1: GGA LYP 0 4 Ec 0.005949133 -0.052316615 0.058265748 2 1: GGA WC 0 1 Ex -0.781236660 -1.024516906 0.243280247 2 1: GGA WC 0 2 Ex -0.749260358 -0.505980122 0.243280236 2 1: GGA WC 0 3 Ex 0.076082067 0.034528400 0.041553667 2 1: GGA WC 0 4 Ex 0.055743278 0.042681448 0.013061830 2 1: GGA PBEJsJrLO 0 1 Ex -0.775066386 -0.983157707 0.208091321 2 1: GGA PBEJsJrLO 0 2 Ex -0.755709545 -0.547618235 0.208091310 2 1: GGA PBEJsJrLO 0 3 Ex 0.046056247 0.008084947 0.037971300 2 1: GGA PBEJsJrLO 0 4 Ex 0.033744170 0.025885694 0.007858476 2 1: GGA PBEJsJrHEG 0 1 Ex -0.762878779 -0.898180300 0.135301521 2 1: GGA PBEJsJrHEG 0 2 Ex -0.758761835 -0.623460323 0.135301511 2 1: GGA PBEJsJrHEG 0 3 Ex 0.009795555 -0.013918188 0.023713743 2 1: GGA PBEJsJrHEG 0 4 Ex 0.007176939 0.000736208 0.006440732 2 1: GGA PBEGcGxLO 0 1 Ex -0.746142748 -0.954432315 0.208289567 2 1: GGA PBEGcGxLO 0 2 Ex -0.727086313 -0.518796756 0.208289556 2 1: GGA PBEGcGxLO 0 3 Ex 0.045341484 0.006252471 0.039089013 2 1: GGA PBEGcGxLO 0 4 Ex 0.033220482 0.026830672 0.006389810 2 1: GGA PBEGcGxHEG 0 1 Ex -0.742418866 -0.882943802 0.140524936 2 1: GGA PBEGcGxHEG 0 2 Ex -0.736837040 -0.596312114 0.140524926 2 1: GGA PBEGcGxHEG 0 3 Ex 0.013280986 -0.011848395 0.025129382 2 1: GGA PBEGcGxHEG 0 4 Ex 0.009730621 0.003723877 0.006006744 2 1: GGA PBESOL 0 1 Ex -0.746142748 -0.954432315 0.208289567 2 1: GGA PBESOL 0 2 Ex -0.727086313 -0.518796756 0.208289556 2 1: GGA PBESOL 0 3 Ex 0.045341484 0.006252471 0.039089013 2 1: GGA PBESOL 0 4 Ex 0.033220482 0.026830672 0.006389810 2 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0.016929915 2 1: GGA revPBE 0 3 Ex 0.029945531 0.042219366 0.012273835 2 1: GGA revPBE 0 4 Ex -0.049765830 -0.035397958 0.014367872 2 1: GGA LYP 0 1 Ex -0.247999365 -0.148348414 0.099650950 2 1: GGA LYP 0 1 Ec 0.111201341 0.211567703 0.100366363 2 1: GGA LYP 0 2 Ex -0.220843027 -0.320493977 0.099650950 2 1: GGA LYP 0 2 Ec 0.043410499 -0.056955863 0.100366362 2 1: GGA LYP 0 3 Ex -0.019810542 -0.051679966 0.031869424 2 1: GGA LYP 0 3 Ec 0.049453403 0.358241060 0.308787657 2 1: GGA LYP 0 4 Ex 0.032922711 0.054844565 0.021921854 2 1: GGA LYP 0 4 Ec -0.082185540 0.145014531 0.227200071 2 1: GGA WC 0 1 Ex -0.202330283 -0.193745015 0.008585268 2 1: GGA WC 0 2 Ex -0.247055040 -0.255640259 0.008585219 2 1: GGA WC 0 3 Ex 0.032626700 0.038847851 0.006221152 2 1: GGA WC 0 4 Ex -0.054221606 -0.046937378 0.007284228 2 1: GGA PBEJsJrLO 0 1 Ex -0.197895875 -0.187412224 0.010483651 2 1: GGA PBEJsJrLO 0 2 Ex -0.238159131 -0.248642734 0.010483603 2 1: GGA PBEJsJrLO 0 3 Ex 0.029372036 0.036972625 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0.026721066 0.035345758 0.008624692 2 1: GGA PBESOL 0 4 Ex -0.044407161 -0.034310708 0.010096453 2 1: GGA AM05 0 1 Ex -0.211435711 -0.147049138 0.064386573 2 1: GGA AM05 0 1 Ec -0.047449637 -0.047487740 0.000038103 2 1: GGA AM05 0 2 Ex -0.188558905 -0.252945478 0.064386573 2 1: GGA AM05 0 2 Ec -0.033177212 -0.033139110 0.000038103 2 1: GGA AM05 0 3 Ex -0.016688625 -0.033015073 0.016326448 2 1: GGA AM05 0 3 Ec -0.010411731 -0.010439338 0.000027607 2 1: GGA AM05 0 4 Ex 0.027734464 0.044465042 0.016730578 2 1: GGA AM05 0 4 Ec 0.017303030 0.017270703 0.000032327 2 1: GGA PW86 0 1 Ex -0.271993863 -0.240452630 0.031541233 2 1: GGA PW86 0 2 Ex -0.263045471 -0.294586652 0.031541181 2 1: GGA PW86 0 3 Ex -0.006527850 0.000969959 0.007497809 2 1: GGA PW86 0 4 Ex 0.010848493 0.028368551 0.017520058 2 1: GGA B88 0 1 Ex -0.247996306 -0.148346219 0.099650087 2 1: GGA B88 0 2 Ex -0.220839333 -0.320489363 0.099650030 2 1: GGA B88 0 3 Ex -0.019811006 -0.051680798 0.031869792 2 1: GGA B88 0 4 Ex 0.032923482 0.054844760 0.021921278 2 1: GGA C09 0 1 Ex -0.221788245 -0.193476568 0.028311677 2 1: GGA C09 0 2 Ex -0.247237862 -0.275549480 0.028311618 2 1: GGA C09 0 3 Ex 0.018565490 0.039113762 0.020548273 2 1: GGA C09 0 4 Ex -0.030853585 -0.006812640 0.024040945 2 1: GGA BH 0 1 Ex -0.272392350 -0.241979662 0.030412687 2 1: GGA BH 0 2 Ex -0.267262438 -0.297675073 0.030412635 2 1: GGA BH 0 3 Ex -0.003742269 0.003164347 0.006906616 2 1: GGA BH 0 4 Ex 0.006219196 0.022918076 0.016698879 2 1: 1: iSpin dens gradDens 1: 1 0.051396216 0.125745446 -0.281433725 0.429383570 1: 2 0.048803808 0.070623352 -0.157464868 -0.265167588 1: 3 -0.004106345 -0.054317846 0.070885548 -0.486779679 1: 4 0.000343435 0.202870605 0.451075531 0.173806589 1: GGA PW91 0 1 Ex -0.892891151 -0.600251619 0.292639532 2 1: GGA PW91 0 2 Ex -0.848839052 -1.141478583 0.292639531 2 1: GGA PW91 0 3 Ex 0.069778029 0.173412149 0.103634120 2 1: GGA PW91 0 4 Ex -0.005835895 0.128794722 0.134630617 2 1: GGA PBE 0 1 Ex -0.674344798 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0.083120658 0.417507551 0.334386893 2 1: GGA PBEGcGxLO 0 1 Ex -1.230783439 -1.180528780 0.050254660 2 1: GGA PBEGcGxLO 0 2 Ex -1.079150888 -1.129405552 0.050254664 2 1: GGA PBEGcGxLO 0 3 Ex -0.103910820 0.171652770 0.275563590 2 1: GGA PBEGcGxLO 0 4 Ex 0.090609335 0.448675749 0.358066414 2 1: GGA PBEGcGxHEG 0 1 Ex -1.240564863 -1.192298079 0.048266784 2 1: GGA PBEGcGxHEG 0 2 Ex -1.097682442 -1.145949231 0.048266789 2 1: GGA PBEGcGxHEG 0 3 Ex -0.097914527 0.132457560 0.230372087 2 1: GGA PBEGcGxHEG 0 4 Ex 0.085380620 0.389958071 0.304577451 2 1: GGA PBESOL 0 1 Ex -1.230783439 -1.180528780 0.050254660 2 1: GGA PBESOL 0 2 Ex -1.079150888 -1.129405552 0.050254664 2 1: GGA PBESOL 0 3 Ex -0.103910820 0.171652770 0.275563590 2 1: GGA PBESOL 0 4 Ex 0.090609335 0.448675749 0.358066414 2 1: GGA AM05 0 1 Ex -1.253007155 -1.238857661 0.014149494 2 1: GGA AM05 0 1 Ec -0.079382930 -0.083472307 0.004089377 2 1: GGA AM05 0 2 Ex -1.087336559 -1.101486053 0.014149494 2 1: GGA AM05 0 2 Ec -0.090678074 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0.007212867 -1.371237008 1.378449875 2 1: GGA LYP 0 3 Ec -0.155254137 0.066498811 0.221752948 2 1: GGA LYP 0 4 Ex 0.001718510 4.678427793 4.676709283 2 1: GGA LYP 0 4 Ec -0.036990261 -0.877448971 0.840458710 2 1: GGA WC 0 1 Ex -0.846618216 -2.339664119 1.493045903 2 1: GGA WC 0 2 Ex -0.859656290 0.633389608 1.493045898 2 1: GGA WC 0 3 Ex -0.059589520 -0.745505312 0.685915792 2 1: GGA WC 0 4 Ex -0.014197573 2.179146744 2.193344317 2 1: GGA PBEJsJrLO 0 1 Ex -0.834763452 -2.417106513 1.582343062 2 1: GGA PBEJsJrLO 0 2 Ex -0.852301390 0.730041667 1.582343057 2 1: GGA PBEJsJrLO 0 3 Ex -0.080155806 -0.699778892 0.619623086 2 1: GGA PBEJsJrLO 0 4 Ex -0.019097618 1.855003268 1.874100886 2 1: GGA PBEJsJrHEG 0 1 Ex -0.858427920 -2.108211939 1.249784019 2 1: GGA PBEJsJrHEG 0 2 Ex -0.876998117 0.372785897 1.249784014 2 1: GGA PBEJsJrHEG 0 3 Ex -0.084873666 -0.466729484 0.381855818 2 1: GGA PBEJsJrHEG 0 4 Ex -0.020221678 1.008631028 1.028852706 2 1: GGA PBEGcGxLO 0 1 Ex -0.818012647 -2.268829455 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GGA AM05 0 3 Ec 0.002347294 0.005735851 0.003388557 2 1: GGA AM05 0 4 Ex 0.012351930 3.192548379 3.180196450 2 1: GGA AM05 0 4 Ec 0.000559257 0.003945737 0.003386479 2 1: GGA PW86 0 1 Ex -0.852360560 -2.859525182 2.007164622 2 1: GGA PW86 0 2 Ex -0.871089156 1.136075460 2.007164616 2 1: GGA PW86 0 3 Ex -0.085597616 -0.836573007 0.750975390 2 1: GGA PW86 0 4 Ex -0.020394163 2.209950224 2.230344387 2 1: GGA B88 0 1 Ex -0.748952467 -3.163351002 2.414398535 2 1: GGA B88 0 2 Ex -0.747371125 1.667027404 2.414398528 2 1: GGA B88 0 3 Ex 0.007227405 -1.370901152 1.378128558 2 1: GGA B88 0 4 Ex 0.001721974 4.677342318 4.675620344 2 1: GGA C09 0 1 Ex -0.699139258 -2.594238128 1.895098870 2 1: GGA C09 0 2 Ex -0.684637613 1.210461252 1.895098864 2 1: GGA C09 0 3 Ex 0.066278659 -1.282560406 1.348839066 2 1: GGA C09 0 4 Ex 0.015791302 4.806923479 4.791132177 2 1: GGA BH 0 1 Ex -0.822071233 -2.459016897 1.636945665 2 1: GGA BH 0 2 Ex -0.839533373 0.797412286 1.636945658 2 1: GGA BH 0 3 Ex -0.079809376 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0.022654443 2 1: GGA revPBE 0 3 Ex 0.115640081 0.259315631 0.143675550 2 1: GGA revPBE 0 4 Ex 0.194854641 0.134590816 0.060263825 2 1: GGA LYP 0 1 Ex -1.112274100 -1.133626975 0.021352875 2 1: GGA LYP 0 1 Ec -0.120445309 -0.119705512 0.000739797 2 1: GGA LYP 0 2 Ex -1.573953918 -1.552601042 0.021352876 2 1: GGA LYP 0 2 Ec -0.039172638 -0.039912435 0.000739797 2 1: GGA LYP 0 3 Ex 0.124127555 0.259943885 0.135816329 2 1: GGA LYP 0 3 Ec -0.021851026 -0.034520332 0.012669306 2 1: GGA LYP 0 4 Ex 0.209156117 0.152119998 0.057036119 2 1: GGA LYP 0 4 Ec -0.036819188 -0.030116849 0.006702340 2 1: GGA WC 0 1 Ex -1.137432796 -1.153781990 0.016349194 2 1: GGA WC 0 2 Ex -1.602070312 -1.585721113 0.016349200 2 1: GGA WC 0 3 Ex 0.124922764 0.228736666 0.103813901 2 1: GGA WC 0 4 Ex 0.210496051 0.166929931 0.043566120 2 1: GGA PBEJsJrLO 0 1 Ex -1.171743489 -1.186677072 0.014933583 2 1: GGA PBEJsJrLO 0 2 Ex -1.596586405 -1.581652817 0.014933588 2 1: GGA PBEJsJrLO 0 3 Ex 0.114223560 0.208312870 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0.210586192 0.089496657 2 1: GGA PBESOL 0 4 Ex 0.204037023 0.166304914 0.037732109 2 1: GGA AM05 0 1 Ex -1.081171526 -1.092487067 0.011315541 2 1: GGA AM05 0 1 Ec -0.112712991 -0.112512639 0.000200352 2 1: GGA AM05 0 2 Ex -1.623602555 -1.612287015 0.011315540 2 1: GGA AM05 0 2 Ec -0.075999904 -0.076200257 0.000200352 2 1: GGA AM05 0 3 Ex 0.145838382 0.225625779 0.079787398 2 1: GGA AM05 0 3 Ec -0.009870706 -0.010567198 0.000696493 2 1: GGA AM05 0 4 Ex 0.245739066 0.210876417 0.034862650 2 1: GGA AM05 0 4 Ec -0.016632234 -0.016440011 0.000192223 2 1: GGA PW86 0 1 Ex -1.256417375 -1.273312360 0.016894986 2 1: GGA PW86 0 2 Ex -1.535858933 -1.518963941 0.016894991 2 1: GGA PW86 0 3 Ex 0.075130851 0.169227885 0.094097034 2 1: GGA PW86 0 4 Ex 0.126596201 0.089399110 0.037197091 2 1: GGA B88 0 1 Ex -1.111100281 -1.132441109 0.021340828 2 1: GGA B88 0 2 Ex -1.571311011 -1.549970177 0.021340834 2 1: GGA B88 0 3 Ex 0.123732575 0.259485586 0.135753010 2 1: GGA B88 0 4 Ex 0.208490572 0.151478730 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PBEJsJrHEG 0 3 Ex 0.294376663 0.263651979 0.030724683 2 1: GGA PBEJsJrHEG 0 4 Ex 0.341960259 0.368417746 0.026457487 2 1: GGA PBEGcGxLO 0 1 Ex -1.266812122 -1.266831853 0.000019731 2 1: GGA PBEGcGxLO 0 2 Ex -1.492821681 -1.492801957 0.000019724 2 1: GGA PBEGcGxLO 0 3 Ex 0.250980817 0.222289401 0.028691415 2 1: GGA PBEGcGxLO 0 4 Ex 0.291549827 0.316256487 0.024706660 2 1: GGA PBEGcGxHEG 0 1 Ex -1.184231791 -1.184249918 0.000018127 2 1: GGA PBEGcGxHEG 0 2 Ex -1.452542310 -1.452524190 0.000018120 2 1: GGA PBEGcGxHEG 0 3 Ex 0.297955509 0.271460715 0.026494794 2 1: GGA PBEGcGxHEG 0 4 Ex 0.346117597 0.368932673 0.022815076 2 1: GGA PBESOL 0 1 Ex -1.266812122 -1.266831853 0.000019731 2 1: GGA PBESOL 0 2 Ex -1.492821681 -1.492801957 0.000019724 2 1: GGA PBESOL 0 3 Ex 0.250980817 0.222289401 0.028691415 2 1: GGA PBESOL 0 4 Ex 0.291549827 0.316256487 0.024706660 2 1: GGA AM05 0 1 Ex -1.737893535 -1.740581560 0.002688025 2 1: GGA AM05 0 2 Ex -1.773593596 -1.770905571 0.002688025 2 1: GGA AM05 0 3 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0.306395625 0.038509840 2 1: GGA RPBE 0 4 Ex 0.484377509 0.457919359 0.026458150 2 1: GGA revPBE 0 1 Ex -0.731583511 -0.808847772 0.077264261 2 1: GGA revPBE 0 2 Ex -0.670917251 -0.593652960 0.077264291 2 1: GGA revPBE 0 3 Ex 0.264553284 0.301116876 0.036563591 2 1: GGA revPBE 0 4 Ex 0.478351848 0.453230875 0.025120973 2 1: GGA LYP 0 1 Ex -28.466262547 -28.533794253 0.067531706 2 1: GGA LYP 0 1 Ec -0.269682926 -0.341539841 0.071856915 2 1: GGA LYP 0 2 Ex -31.652626940 -31.585173554 0.067453387 2 1: GGA LYP 0 2 Ec -0.296680578 -0.224823663 0.071856915 2 1: GGA LYP 0 3 Ex -13.895090426 -13.893943554 0.001146872 2 1: GGA LYP 0 3 Ec -0.117731296 -0.049275069 0.068456228 2 1: GGA LYP 0 4 Ex -25.124398697 -25.129395441 0.004996743 2 1: GGA LYP 0 4 Ec -0.212875767 -0.255292170 0.042416403 2 1: GGA WC 0 1 Ex -0.776473036 -0.822956843 0.046483807 2 1: GGA WC 0 2 Ex -0.707922103 -0.661438272 0.046483830 2 1: GGA WC 0 3 Ex 0.298936752 0.320934184 0.021997432 2 1: GGA WC 0 4 Ex 0.540522293 0.525408994 0.015113299 2 1: GGA PBEJsJrLO 0 1 Ex -0.750530902 -0.802730639 0.052199736 2 1: GGA PBEJsJrLO 0 2 Ex -0.684703731 -0.632503971 0.052199760 2 1: GGA PBEJsJrLO 0 3 Ex 0.287058977 0.311761344 0.024702367 2 1: GGA PBEJsJrLO 0 4 Ex 0.519045502 0.502073776 0.016971725 2 1: GGA PBEJsJrHEG 0 1 Ex -0.757144081 -0.802518860 0.045374779 2 1: GGA PBEJsJrHEG 0 2 Ex -0.688810250 -0.643435450 0.045374800 2 1: GGA PBEJsJrHEG 0 3 Ex 0.297990010 0.319462618 0.021472608 2 1: GGA PBEJsJrHEG 0 4 Ex 0.538810442 0.524057719 0.014752723 2 1: GGA PBEGcGxLO 0 1 Ex -0.756956400 -0.802148478 0.045192079 2 1: GGA PBEGcGxLO 0 2 Ex -0.690454591 -0.645262489 0.045192102 2 1: GGA PBEGcGxLO 0 3 Ex 0.290000933 0.311387083 0.021386150 2 1: GGA PBEGcGxLO 0 4 Ex 0.524364997 0.509671678 0.014693319 2 1: GGA PBEGcGxHEG 0 1 Ex -0.759888274 -0.800034006 0.040145731 2 1: GGA PBEGcGxHEG 0 2 Ex -0.691266321 -0.651120569 0.040145751 2 1: GGA PBEGcGxHEG 0 3 Ex 0.299246457 0.318244536 0.018998079 2 1: GGA PBEGcGxHEG 0 4 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GGA PW91 0 2 Ex -0.599168790 -0.514517495 0.084651295 2 1: GGA PW91 0 3 Ex -0.003580631 0.100590777 0.104171409 2 1: GGA PW91 0 4 Ex -0.006492440 -0.076927996 0.070435556 2 1: GGA PBE 0 1 Ex -0.548535799 -0.622806256 0.074270458 2 1: GGA PBE 0 2 Ex -0.529304398 -0.455033955 0.074270443 2 1: GGA PBE 0 3 Ex 0.034574093 0.107638029 0.073063936 2 1: GGA PBE 0 4 Ex 0.062690123 0.011002844 0.051687278 2 1: GGA RPBE 0 1 Ex -0.559819209 -0.670867872 0.111048662 2 1: GGA RPBE 0 2 Ex -0.560438421 -0.449389774 0.111048647 2 1: GGA RPBE 0 3 Ex -0.001113215 0.119621393 0.120734608 2 1: GGA RPBE 0 4 Ex -0.002018494 -0.085637731 0.083619237 2 1: GGA revPBE 0 1 Ex -0.520218526 -0.628212522 0.107993996 2 1: GGA revPBE 0 2 Ex -0.511932453 -0.403938472 0.107993980 2 1: GGA revPBE 0 3 Ex 0.014896652 0.116017569 0.101120917 2 1: GGA revPBE 0 4 Ex 0.027010772 -0.045322823 0.072333595 2 1: GGA LYP 0 1 Ex -0.440910857 -0.537350432 0.096439575 2 1: GGA LYP 0 1 Ec -0.024154474 -0.189382205 0.165227731 2 1: GGA LYP 0 2 Ex -0.410090802 -0.313651227 0.096439575 2 1: GGA LYP 0 2 Ec -0.043433693 0.121794038 0.165227731 2 1: GGA LYP 0 3 Ex 0.055408104 0.114718685 0.059310581 2 1: GGA LYP 0 3 Ec -0.034660059 0.158167260 0.192827319 2 1: GGA LYP 0 4 Ex 0.100466579 0.052963983 0.047502596 2 1: GGA LYP 0 4 Ec -0.062845998 -0.194535164 0.131689166 2 1: GGA WC 0 1 Ex -0.510484544 -0.588461372 0.077976828 2 1: GGA WC 0 2 Ex -0.497005243 -0.419028428 0.077976815 2 1: GGA WC 0 3 Ex 0.024233004 0.100241027 0.076008022 2 1: GGA WC 0 4 Ex 0.043939548 -0.009939917 0.053879465 2 1: GGA PBEJsJrLO 0 1 Ex -0.514106229 -0.584938939 0.070832710 2 1: GGA PBEJsJrLO 0 2 Ex -0.495148128 -0.424315432 0.070832696 2 1: GGA PBEJsJrLO 0 3 Ex 0.034082756 0.101006299 0.066923542 2 1: GGA PBEJsJrLO 0 4 Ex 0.061799226 0.014025721 0.047773506 2 1: GGA PBEJsJrHEG 0 1 Ex -0.529977772 -0.580975994 0.050998222 2 1: GGA PBEJsJrHEG 0 2 Ex -0.504500165 -0.453501956 0.050998209 2 1: GGA PBEJsJrHEG 0 3 Ex 0.045803484 0.095991264 0.050187780 2 1: GGA PBEJsJrHEG 0 4 Ex 0.083051377 0.047550081 0.035501296 2 1: GGA PBEGcGxLO 0 1 Ex -0.498916937 -0.565939478 0.067022541 2 1: GGA PBEGcGxLO 0 2 Ex -0.478922205 -0.411899676 0.067022529 2 1: GGA PBEGcGxLO 0 3 Ex 0.035946405 0.097382631 0.061436226 2 1: GGA PBEGcGxLO 0 4 Ex 0.065178414 0.021015628 0.044162787 2 1: GGA PBEGcGxHEG 0 1 Ex -0.516285408 -0.566434504 0.050149096 2 1: GGA PBEGcGxHEG 0 2 Ex -0.491174126 -0.441025042 0.050149084 2 1: GGA PBEGcGxHEG 0 3 Ex 0.045144907 0.093523167 0.048378260 2 1: GGA PBEGcGxHEG 0 4 Ex 0.081857238 0.047484149 0.034373089 2 1: GGA PBESOL 0 1 Ex -0.498916937 -0.565939478 0.067022541 2 1: GGA PBESOL 0 2 Ex -0.478922205 -0.411899676 0.067022529 2 1: GGA PBESOL 0 3 Ex 0.035946405 0.097382631 0.061436226 2 1: GGA PBESOL 0 4 Ex 0.065178414 0.021015628 0.044162787 2 1: GGA AM05 0 1 Ex -0.408498933 -0.464833787 0.056334854 2 1: GGA AM05 0 1 Ec -0.061416472 -0.060859006 0.000557466 2 1: GGA AM05 0 2 Ex -0.375534252 -0.319199398 0.056334854 2 1: GGA AM05 0 2 Ec -0.069512397 -0.070069863 0.000557466 2 1: GGA AM05 0 3 Ex 0.059263699 0.089798887 0.030535189 2 1: GGA AM05 0 3 Ec -0.014554804 -0.015119123 0.000564319 2 1: GGA AM05 0 4 Ex 0.107457586 0.081976291 0.025481295 2 1: GGA AM05 0 4 Ec -0.026390929 -0.025994196 0.000396733 2 1: GGA PW86 0 1 Ex -0.538160539 -0.606387879 0.068227340 2 1: GGA PW86 0 2 Ex -0.507208466 -0.438981140 0.068227326 2 1: GGA PW86 0 3 Ex 0.055645444 0.109535929 0.053890485 2 1: GGA PW86 0 4 Ex 0.100896928 0.060710879 0.040186049 2 1: GGA B88 0 1 Ex -0.440828243 -0.537254783 0.096426540 2 1: GGA B88 0 2 Ex -0.410022485 -0.313595960 0.096426525 2 1: GGA B88 0 3 Ex 0.055382401 0.114680286 0.059297885 2 1: GGA B88 0 4 Ex 0.100419974 0.052926378 0.047493596 2 1: GGA C09 0 1 Ex -0.428476260 -0.517247856 0.088771597 2 1: GGA C09 0 2 Ex -0.411455152 -0.322683569 0.088771583 2 1: GGA C09 0 3 Ex 0.030600442 0.095516302 0.064915860 2 1: GGA C09 0 4 Ex 0.055485055 0.006067253 0.049417802 2 1: GGA BH 0 1 Ex 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1: 3 -0.000460546 0.009394174 -0.010808421 -0.005612517 1: 4 -0.000738844 0.008169526 0.009569661 0.006121137 1: GGA PW91 0 1 Ex -0.257238338 -0.297370718 0.040132380 2 1: GGA PW91 0 2 Ex -0.112516812 -0.072384426 0.040132386 2 1: GGA PW91 0 3 Ex 0.089886419 0.066674115 0.023212304 2 1: GGA PW91 0 4 Ex 0.144202885 0.138533506 0.005669379 2 1: GGA PBE 0 1 Ex -0.219875800 -0.217602246 0.002273554 2 1: GGA PBE 0 2 Ex -0.161603216 -0.163876761 0.002273545 2 1: GGA PBE 0 3 Ex 0.036193053 0.037508068 0.001315014 2 1: GGA PBE 0 4 Ex 0.058063752 0.058384900 0.000321148 2 1: GGA revPBE 0 1 Ex -0.260176161 -0.255013441 0.005162720 2 1: GGA revPBE 0 2 Ex -0.195225688 -0.200388396 0.005162708 2 1: GGA revPBE 0 3 Ex 0.040340685 0.043326783 0.002986098 2 1: GGA revPBE 0 4 Ex 0.064717710 0.065446988 0.000729278 2 1: GGA LYP 0 1 Ex -0.248909839 -0.173718743 0.075191096 2 1: GGA LYP 0 1 Ec -0.734374661 -0.535699733 0.198674928 2 1: GGA LYP 0 2 Ex -0.336725001 -0.411916096 0.075191095 2 1: GGA LYP 0 2 Ec -1.063948337 -1.262623268 0.198674930 2 1: GGA LYP 0 3 Ex -0.054541924 -0.028446608 0.026095316 2 1: GGA LYP 0 3 Ec -0.204697935 -0.018049603 0.186648333 2 1: GGA LYP 0 4 Ex -0.087500458 -0.066035766 0.021464692 2 1: GGA LYP 0 4 Ec -0.328392578 -0.345041904 0.016649326 2 1: GGA WC 0 1 Ex -0.218492327 -0.216119356 0.002372972 2 1: GGA WC 0 2 Ex -0.160995233 -0.163368195 0.002372963 2 1: GGA WC 0 3 Ex 0.035711397 0.037083889 0.001372491 2 1: GGA WC 0 4 Ex 0.057291041 0.057626249 0.000335208 2 1: GGA PBEJsJrLO 0 1 Ex -0.214770458 -0.211617193 0.003153266 2 1: GGA PBEJsJrLO 0 2 Ex -0.159370235 -0.162523491 0.003153256 2 1: GGA PBEJsJrLO 0 3 Ex 0.034409032 0.036232869 0.001823836 2 1: GGA PBEJsJrLO 0 4 Ex 0.055201685 0.055647105 0.000445420 2 1: GGA PBEJsJrHEG 0 1 Ex -0.191424472 -0.189869285 0.001555186 2 1: GGA PBEJsJrHEG 0 2 Ex -0.140018635 -0.141573814 0.001555178 2 1: GGA PBEJsJrHEG 0 3 Ex 0.031928122 0.032827634 0.000899512 2 1: GGA PBEJsJrHEG 0 4 Ex 0.051221613 0.051441284 0.000219672 2 1: GGA PBEGcGxLO 0 1 Ex -0.211291484 -0.207547854 0.003743630 2 1: GGA PBEGcGxLO 0 2 Ex -0.157848506 -0.161592127 0.003743621 2 1: GGA PBEGcGxLO 0 3 Ex 0.033193389 0.035358689 0.002165300 2 1: GGA PBEGcGxLO 0 4 Ex 0.053251454 0.053780272 0.000528818 2 1: GGA PBEGcGxHEG 0 1 Ex -0.189640698 -0.187776783 0.001863915 2 1: GGA PBEGcGxHEG 0 2 Ex -0.139238459 -0.141102367 0.001863907 2 1: GGA PBEGcGxHEG 0 3 Ex 0.031304788 0.032382868 0.001078080 2 1: GGA PBEGcGxHEG 0 4 Ex 0.050221611 0.050484896 0.000263284 2 1: GGA PBESOL 0 1 Ex -0.211291484 -0.207547854 0.003743630 2 1: GGA PBESOL 0 2 Ex -0.157848506 -0.161592127 0.003743621 2 1: GGA PBESOL 0 3 Ex 0.033193389 0.035358689 0.002165300 2 1: GGA PBESOL 0 4 Ex 0.053251454 0.053780272 0.000528818 2 1: GGA AM05 0 1 Ex -0.209213119 -0.160263998 0.048949122 2 1: GGA AM05 0 1 Ec -0.029011092 -0.029020789 0.000009697 2 1: GGA AM05 0 2 Ex -0.285012781 -0.333961903 0.048949122 2 1: GGA AM05 0 2 Ec -0.045229571 -0.045219874 0.000009697 2 1: GGA AM05 0 3 Ex -0.047079107 -0.028713953 0.018365153 2 1: GGA AM05 0 3 Ec -0.010073284 -0.010078892 0.000005609 2 1: GGA AM05 0 4 Ex -0.075528018 -0.062413038 0.013114980 2 1: GGA AM05 0 4 Ec -0.016160356 -0.016161726 0.000001370 2 1: GGA PW86 0 1 Ex -0.259424377 -0.236371810 0.023052567 2 1: GGA PW86 0 2 Ex -0.296980200 -0.320032756 0.023052556 2 1: GGA PW86 0 3 Ex -0.023325890 -0.011468395 0.011857495 2 1: GGA PW86 0 4 Ex -0.037421234 -0.033244698 0.004176536 2 1: GGA B88 0 1 Ex -0.248907242 -0.173716701 0.075190542 2 1: GGA B88 0 2 Ex -0.336722431 -0.411912963 0.075190532 2 1: GGA B88 0 3 Ex -0.054541941 -0.028446933 0.026095008 2 1: GGA B88 0 4 Ex -0.087500484 -0.066035939 0.021464545 2 1: GGA C09 0 1 Ex -0.272281324 -0.270058974 0.002222350 2 1: GGA C09 0 2 Ex -0.200526143 -0.202748482 0.002222338 2 1: GGA C09 0 3 Ex 0.044567083 0.045852513 0.001285431 2 1: GGA C09 0 4 Ex 0.071498030 0.071811918 0.000313888 2 1: GGA BH 0 1 Ex -0.262045308 -0.239940336 0.022104972 2 1: GGA BH 0 2 Ex -0.295664578 -0.317769540 0.022104961 2 1: GGA BH 0 3 Ex -0.020880901 -0.009551315 0.011329585 2 1: GGA BH 0 4 Ex -0.033498788 -0.029468690 0.004030098 2 1: 1: Some errors found. Error codes: 1: error 1 => V=dE/dDens is positive 1: error 2 => analytical and numerical value of dE/dDens differ 1: error 3 => analytical and numerical value of dE/dGradDens differ 6/9 Test #1: libgridxc_test1 .................. Passed 0.31 sec 3: Ex, Ec = -3.716289981 -0.771674483 3: Dx, Dc = 1.192543612 0.121155159 3: i1 i2 i3 iSpin Vxc dExc/dDens diff 3: 2 8 13 2 -0.313847006 -0.313846990 -0.000000016 3: 4 2 23 2 -0.524218962 -0.524218953 -0.000000009 2: 2: funcs= VDW 2: auths= BH 2: dr, rMax = 0.200000 20.000000 2: iSpin r dens Vxc dExc/dDens diff 2: 1 0.000 0.047620227 -0.999477920 2: 1 0.200 0.047382720 -0.999360161 -1.000195026 0.000834865 2: 1 0.400 0.046677283 -0.999006885 -0.998709202 -0.000297683 3: 5 6 2 1 -0.626312320 -0.626312325 0.000000005 2: 1 0.600 0.045524817 -0.987412253 -0.987507999 0.000095746 2: 1 0.800 0.043959010 -0.980158453 -0.980143428 -0.000015025 2: 1 1.000 0.042024703 -0.963929151 -0.963927478 -0.000001674 2: 1 1.200 0.039775757 -0.949006509 -0.949005827 -0.000000682 3: 4 2 9 2 -0.561691010 -0.561691005 -0.000000005 2: 1 1.400 0.037272568 -0.929353368 -0.929356366 0.000002998 2: 1 1.600 0.034579382 -0.908100586 -0.908099070 -0.000001516 2: 1 1.800 0.031761587 -0.884442948 -0.884442169 -0.000000779 2: 1 2.000 0.028883127 -0.858808538 -0.858809371 0.000000832 3: 7 3 21 1 -0.491741169 -0.491741176 0.000000007 2: 1 2.200 0.026004187 -0.831341143 -0.831341114 -0.000000029 2: 1 2.400 0.023179251 -0.802320622 -0.802320395 -0.000000227 2: 1 2.600 0.020455616 -0.772056571 -0.772056924 0.000000353 2: 1 2.800 0.017872394 -0.740675199 -0.740674874 -0.000000326 3: 1 2 0 2 -0.680189858 -0.680189869 0.000000011 2: 1 3.000 0.015460016 -0.708430779 -0.708429554 -0.000001224 2: 1 3.200 0.013240188 -0.675669578 -0.675674008 0.000004431 2: 1 3.400 0.011226266 -0.642459702 -0.642454693 -0.000005009 2: 1 3.600 0.009423960 -0.609091304 -0.609092449 0.000001145 2: 1 3.800 0.007832284 -0.575839731 -0.575841531 0.000001800 2: 1 4.000 0.006444664 -0.542697531 -0.542696461 -0.000001070 2: 1 4.200 0.005250115 -0.510078329 -0.510077513 -0.000000816 2: 1 4.400 0.004234421 -0.478003232 -0.478007540 0.000004308 2: 1 4.600 0.003381238 -0.446577649 -0.446566565 -0.000011084 2: 1 4.800 0.002673091 -0.416186718 -0.416202730 0.000016011 2: 1 5.000 0.002092223 -0.386734472 -0.386724840 -0.000009632 2: 1 5.200 0.001621280 -0.359258071 -0.359253814 -0.000004257 2: 1 5.400 0.001243837 -0.329009264 -0.329019031 0.000009767 2: 1 5.600 0.000944766 -0.268263860 -0.268258609 -0.000005251 2: 1 5.800 0.000710460 -0.184072378 -0.184073423 0.000001045 2: 1 6.000 0.000528944 -0.147193854 -0.147194457 0.000000603 2: 1 6.200 0.000389881 -0.169127143 -0.169125286 -0.000001857 2: 1 6.400 0.000284517 -0.195915387 -0.195917508 0.000002121 2: 1 6.600 0.000205559 -0.203472102 -0.203471426 -0.000000676 2: 1 6.800 0.000147033 -0.198598658 -0.198597592 -0.000001066 2: 1 7.000 0.000104122 -0.189565923 -0.189567430 0.000001507 2: 1 7.200 0.000072999 -0.181016372 -0.181015280 -0.000001093 2: 1 7.400 0.000050669 -0.173604245 -0.173604994 0.000000748 2: 1 7.600 0.000034818 -0.165710223 -0.165709116 -0.000001106 2: 1 7.800 0.000023687 -0.155572229 -0.155573540 0.000001311 2: 1 8.000 0.000015954 -0.142174017 -0.142175066 0.000001050 2: 1 8.200 0.000010638 -0.126477393 -0.126473509 -0.000003883 2: 1 8.400 0.000007022 -0.110553043 -0.110555103 0.000002060 2: 1 8.600 0.000004589 -0.096226748 -0.096227608 0.000000861 2: 1 8.800 0.000002969 -0.084195519 -0.084194595 -0.000000924 2: 1 9.000 0.000001902 -0.074352560 -0.074354361 0.000001801 2: 1 9.200 0.000001206 -0.066227937 -0.066230345 0.000002408 2: 1 9.400 0.000000757 -0.059254673 -0.059259092 0.000004419 2: 1 9.600 0.000000470 -0.053256096 -0.053258876 0.000002780 2: 1 9.800 0.000000289 -0.047889328 -0.047892333 0.000003005 2: 1 10.000 0.000000176 -0.043050812 -0.043053582 0.000002771 2: 1 10.200 0.000000106 -0.038722914 -0.038725317 0.000002403 2: 1 10.400 0.000000063 -0.034770816 -0.034772940 0.000002124 2: 1 10.600 0.000000037 -0.031177334 -0.031179201 0.000001867 2: 1 10.800 0.000000022 -0.027908137 -0.027909793 0.000001656 2: 1 11.000 0.000000013 -0.024937534 -0.024938986 0.000001452 2: 1 11.200 0.000000007 -0.022242269 -0.022243500 0.000001230 2: 1 11.400 0.000000004 -0.019801203 -0.019802302 0.000001099 2: 1 11.600 0.000000002 -0.017594752 -0.017596006 0.000001255 2: 1 11.800 0.000000001 -0.015604553 -0.015605092 0.000000539 2: iSpin r dens Vxc dExc/dDens diff 2: 2 0.000 0.031746818 -0.915508806 2: 2 0.200 0.031588480 -0.915751674 -0.916586876 0.000835202 2: 2 0.400 0.031118189 -0.916480278 -0.916182756 -0.000297522 2: 2 0.600 0.030349878 -0.905234497 -0.905330241 0.000095744 2: 2 0.800 0.029306007 -0.899618247 -0.899603248 -0.000014999 2: 2 1.000 0.028016469 -0.884545454 -0.884543777 -0.000001678 2: 2 1.200 0.026517171 -0.871612702 -0.871612027 -0.000000675 2: 2 1.400 0.024848378 -0.853952605 -0.853955589 0.000002984 2: 2 1.600 0.023052921 -0.835057592 -0.835056074 -0.000001518 2: 2 1.800 0.021174391 -0.813963082 -0.813962311 -0.000000772 2: 2 2.000 0.019255418 -0.791103995 -0.791104827 0.000000832 2: 2 2.200 0.017336125 -0.766590785 -0.766590763 -0.000000022 2: 2 2.400 0.015452834 -0.740674175 -0.740673948 -0.000000227 2: 2 2.600 0.013637077 -0.713633471 -0.713633822 0.000000351 2: 2 2.800 0.011914930 -0.685564496 -0.685564173 -0.000000323 2: 2 3.000 0.010306678 -0.656691901 -0.656690676 -0.000001225 2: 2 3.200 0.008826792 -0.627334141 -0.627338570 0.000004429 2: 2 3.400 0.007484177 -0.597534542 -0.597529527 -0.000005015 2: 2 3.600 0.006282640 -0.567562765 -0.567563906 0.000001141 2: 2 3.800 0.005221523 -0.537678412 -0.537680208 0.000001796 2: 2 4.000 0.004296443 -0.507860006 -0.507858935 -0.000001072 2: 2 4.200 0.003500077 -0.478500307 -0.478499493 -0.000000815 2: 2 4.400 0.002822947 -0.449602251 -0.449606558 0.000004308 2: 2 4.600 0.002254159 -0.421308745 -0.421297660 -0.000011084 2: 2 4.800 0.001782061 -0.394081537 -0.394097552 0.000016014 2: 2 5.000 0.001394815 -0.368503162 -0.368493533 -0.000009629 2: 2 5.200 0.001080853 -0.338654863 -0.338650607 -0.000004256 2: 2 5.400 0.000829225 -0.277895720 -0.277905487 0.000009768 2: 2 5.600 0.000629844 -0.196381546 -0.196376298 -0.000005249 2: 2 5.800 0.000473640 -0.161618667 -0.161619714 0.000001047 2: 2 6.000 0.000352629 -0.182070066 -0.182070668 0.000000602 2: 2 6.200 0.000259921 -0.206718897 -0.206717038 -0.000001859 2: 2 6.400 0.000189678 -0.212964826 -0.212966944 0.000002118 2: 2 6.600 0.000137039 -0.206427971 -0.206427295 -0.000000676 2: 2 6.800 0.000098022 -0.195576084 -0.195575021 -0.000001063 2: 2 7.000 0.000069415 -0.184792808 -0.184794315 0.000001508 2: 2 7.200 0.000048666 -0.176119925 -0.176118834 -0.000001092 2: 2 7.400 0.000033779 -0.169045503 -0.169046254 0.000000751 2: 2 7.600 0.000023212 -0.161554180 -0.161553078 -0.000001102 2: 2 7.800 0.000015792 -0.151793526 -0.151794847 0.000001322 2: 2 8.000 0.000010636 -0.138751509 -0.138752581 0.000001072 2: 2 8.200 0.000007092 -0.123406831 -0.123402998 -0.000003833 2: 2 8.400 0.000004681 -0.107833248 -0.107835424 0.000002176 2: 2 8.600 0.000003059 -0.093844217 -0.093845341 0.000001124 2: 2 8.800 0.000001979 -0.082118108 -0.082117785 -0.000000323 2: 2 9.000 0.000001268 -0.072533230 -0.072536399 0.000003169 2: 2 9.200 0.000000804 -0.064613896 -0.064617440 0.000003544 2: 2 9.400 0.000000504 -0.057796389 -0.057800206 0.000003817 2: 2 9.600 0.000000313 -0.051913010 -0.051915901 0.000002891 2: 2 9.800 0.000000193 -0.046631823 -0.046634643 0.000002820 2: 2 10.000 0.000000117 -0.041859516 -0.041862071 0.000002554 2: 2 10.200 0.000000071 -0.037586671 -0.037588902 0.000002231 2: 2 10.400 0.000000042 -0.033684342 -0.033686314 0.000001972 2: 2 10.600 0.000000025 -0.030139120 -0.030140869 0.000001749 2: 2 10.800 0.000000015 -0.026918806 -0.026920326 0.000001520 2: 2 11.000 0.000000008 -0.023998661 -0.023999989 0.000001328 2: 2 11.200 0.000000005 -0.021355613 -0.021356851 0.000001238 2: 2 11.400 0.000000003 -0.018968230 -0.018969178 0.000000948 2: 2 11.600 0.000000002 -0.016816386 -0.016817153 0.000000767 2: avgDiffVxc, maxDiffVxc = 0.000088779 0.000835202 7/9 Test #2: libgridxc_test2 .................. Passed 12.51 sec 4: 4: funcs= VDW 4: auths= BH 4: dr, dx, Ecut = 0.024000 0.408248 59.217626 4: rMax, rBuff = 12.000000 3.000000 4: atomEx, cellEx, diff = -4.299743248 -4.299745396 0.000002148 4: atomEc, cellEc, diff = -0.679499275 -0.679753307 0.000254032 4: atomDx, cellDx, diff = 1.349799036 1.349797201 0.000001835 4: atomDc, cellDc, diff = 0.155982425 0.155866069 0.000116356 4: avgDiffVxc, maxDiffVxc = 0.000006162 0.038047291 8/9 Test #4: libgridxc_test4 .................. Passed 12.84 sec 3: xc stress * volume = 3: -4.405894836 -0.011039400 0.003122993 3: -0.011039400 -4.442866097 0.004079677 3: 0.003122993 0.004079677 -4.466819185 3: dExc/dStrain = 3: -4.405917144 -0.011032696 0.003063851 3: -0.011032696 -4.442868111 0.004097451 3: 0.003063851 0.004097451 -4.466975974 3: diff = 3: 0.000022309 -0.000006705 0.000059142 3: -0.000006705 0.000002015 -0.000017774 3: 0.000059142 -0.000017774 0.000156789 9/9 Test #3: libgridxc_test3 .................. Passed 21.58 sec 100% tests passed, 0 tests failed out of 9 Total Test time (real) = 21.59 sec make[1]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' create-stamp debian/debhelper-build-stamp dh_testroot -O--buildsystem=cmake dh_prep -O--buildsystem=cmake dh_auto_install --destdir=debian/libgridxc-dev/ -O--buildsystem=cmake cd obj-x86_64-linux-gnu && make -j20 install DESTDIR=/build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev AM_UPDATE_INFO_DIR=no "INSTALL=install --strip-program=true" make[1]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' /usr/bin/cmake -S/build/reproducible-path/libgridxc-2.1.0 -B/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu --check-build-system CMakeFiles/Makefile.cmake 0 /usr/bin/cmake -E cmake_progress_start /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/CMakeFiles /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu//CMakeFiles/progress.marks make -f CMakeFiles/Makefile2 all make[2]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' make -f CMakeFiles/libgridxc-lib.dir/build.make CMakeFiles/libgridxc-lib.dir/depend make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' cd /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.1.0 /build/reproducible-path/libgridxc-2.1.0 /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/CMakeFiles/libgridxc-lib.dir/DependInfo.cmake "--color=" make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' make -f CMakeFiles/libgridxc-lib.dir/build.make CMakeFiles/libgridxc-lib.dir/build make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' make[3]: Nothing to be done for 'CMakeFiles/libgridxc-lib.dir/build'. make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' [ 64%] Built target libgridxc-lib make -f Testers/CMakeFiles/libgridxc-test1.dir/build.make Testers/CMakeFiles/libgridxc-test1.dir/depend make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' cd /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.1.0 /build/reproducible-path/libgridxc-2.1.0/Testers /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test1.dir/DependInfo.cmake "--color=" make -f Testers/CMakeFiles/libgridxc-test2.dir/build.make Testers/CMakeFiles/libgridxc-test2.dir/depend make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' cd /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.1.0 /build/reproducible-path/libgridxc-2.1.0/Testers /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test2.dir/DependInfo.cmake "--color=" make -f Testers/CMakeFiles/libgridxc-test3.dir/build.make Testers/CMakeFiles/libgridxc-test3.dir/depend make -f Testers/CMakeFiles/libgridxc-test4.dir/build.make Testers/CMakeFiles/libgridxc-test4.dir/depend make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' cd /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.1.0 /build/reproducible-path/libgridxc-2.1.0/Testers /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test3.dir/DependInfo.cmake "--color=" make -f Testers/CMakeFiles/libgridxc-test6.dir/build.make Testers/CMakeFiles/libgridxc-test6.dir/depend make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' cd /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.1.0 /build/reproducible-path/libgridxc-2.1.0/Testers /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers 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'/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' cd /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.1.0 /build/reproducible-path/libgridxc-2.1.0/Testers /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test_libxc.dir/DependInfo.cmake "--color=" make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' cd /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.1.0 /build/reproducible-path/libgridxc-2.1.0/Testers /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers 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"--color=" make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' make[3]: Nothing to be done for 'Testers/CMakeFiles/libgridxc-test3.dir/build'. make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' make -f Testers/CMakeFiles/libgridxc-test1.dir/build.make Testers/CMakeFiles/libgridxc-test1.dir/build make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' make[3]: Nothing to be done for 'Testers/CMakeFiles/libgridxc-test1.dir/build'. make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' make -f Testers/CMakeFiles/libgridxc-test2.dir/build.make Testers/CMakeFiles/libgridxc-test2.dir/build make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' make[3]: Nothing to be done for 'Testers/CMakeFiles/libgridxc-test2.dir/build'. make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' make -f Testers/CMakeFiles/libgridxc-test6.dir/build.make Testers/CMakeFiles/libgridxc-test6.dir/build make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' make -f Testers/CMakeFiles/libgridxc-test4.dir/build.make Testers/CMakeFiles/libgridxc-test4.dir/build make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' make[3]: Nothing to be done for 'Testers/CMakeFiles/libgridxc-test6.dir/build'. make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' make -f Testers/CMakeFiles/libgridxc-test_libxc.dir/build.make Testers/CMakeFiles/libgridxc-test_libxc.dir/build make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' make[3]: Nothing to be done for 'Testers/CMakeFiles/libgridxc-test4.dir/build'. make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' make[3]: Nothing to be done for 'Testers/CMakeFiles/libgridxc-test_libxc.dir/build'. make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' make -f Testers/CMakeFiles/libgridxc-test_libxc2.dir/build.make Testers/CMakeFiles/libgridxc-test_libxc2.dir/build make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' make[3]: Nothing to be done for 'Testers/CMakeFiles/libgridxc-test_libxc2.dir/build'. make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' [ 68%] Built target libgridxc-test3 [ 72%] Built target libgridxc-test1 make -f Testers/CMakeFiles/libgridxc-test_match.dir/build.make Testers/CMakeFiles/libgridxc-test_match.dir/build make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' make[3]: Nothing to be done for 'Testers/CMakeFiles/libgridxc-test_match.dir/build'. make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' [ 76%] Built target libgridxc-test2 make -f Testers/CMakeFiles/libgridxc-test_hse06.dir/build.make Testers/CMakeFiles/libgridxc-test_hse06.dir/depend [ 80%] Built target libgridxc-test6 [ 84%] Built target libgridxc-test4 make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' cd /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.1.0 /build/reproducible-path/libgridxc-2.1.0/Testers /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/Testers/CMakeFiles/libgridxc-test_hse06.dir/DependInfo.cmake "--color=" [ 88%] Built target libgridxc-test_libxc2 [ 92%] Built target libgridxc-test_libxc [ 96%] Built target libgridxc-test_match make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' make -f Testers/CMakeFiles/libgridxc-test_hse06.dir/build.make Testers/CMakeFiles/libgridxc-test_hse06.dir/build make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' make[3]: Nothing to be done for 'Testers/CMakeFiles/libgridxc-test_hse06.dir/build'. make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' [100%] Built target libgridxc-test_hse06 make[2]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' /usr/bin/cmake -E cmake_progress_start /build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu/CMakeFiles 0 make -f CMakeFiles/Makefile2 preinstall make[2]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' make[2]: Nothing to be done for 'preinstall'. make[2]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' Install the project... /usr/bin/cmake -P cmake_install.cmake -- Install configuration: "RelWithDebInfo" -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/lib/x86_64-linux-gnu/cmake/libgridxc/libgridxc-config.cmake -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/lib/x86_64-linux-gnu/cmake/libgridxc/libgridxc-config-version.cmake -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/lib/x86_64-linux-gnu/pkgconfig/libgridxc.pc -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/lib/x86_64-linux-gnu/libgridxc.a -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/lib/x86_64-linux-gnu/cmake/libgridxc/libgridxc-targets.cmake -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/lib/x86_64-linux-gnu/cmake/libgridxc/libgridxc-targets-relwithdebinfo.cmake -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0 -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_walltime.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_bessph.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_vdwxc.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_gpfa_core_dp.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_fftr.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_debugxc.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_io.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_precision.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_atom.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_am05.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_config.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_gpfa_core_sp.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_xcmod.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_xwpbe.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_moreparallelsubs.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_sys.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_mesh1d.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_cellsubs.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_fft_gpfa.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_cell.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_chkgmx.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_sorting.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_fft3d.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_interpolation.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_array.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_gga.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_radfft.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_minvec.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_mesh3d.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_vv_vdwxc.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_lda.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_hybrids.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_alloc.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/share/licenses/libgridxc/COPYING make[1]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-x86_64-linux-gnu' dh_installdocs -O--buildsystem=cmake dh_installchangelogs -O--buildsystem=cmake dh_installinit -O--buildsystem=cmake dh_installsystemduser -O--buildsystem=cmake dh_perl -O--buildsystem=cmake dh_link -O--buildsystem=cmake dh_strip_nondeterminism -O--buildsystem=cmake dh_compress -O--buildsystem=cmake dh_fixperms -O--buildsystem=cmake dh_missing -O--buildsystem=cmake dh_dwz -O--buildsystem=cmake dh_strip -O--buildsystem=cmake dh_makeshlibs -O--buildsystem=cmake dh_shlibdeps -O--buildsystem=cmake dh_installdeb -O--buildsystem=cmake dh_gencontrol -O--buildsystem=cmake dpkg-gencontrol: warning: Depends field of package libgridxc-dev: substitution variable ${shlibs:Depends} used, but is not defined dh_md5sums -O--buildsystem=cmake dh_builddeb -O--buildsystem=cmake dpkg-deb: building package 'libgridxc-dev' in '../libgridxc-dev_2.1.0-1_amd64.deb'. dpkg-genbuildinfo --build=binary -O../libgridxc_2.1.0-1_amd64.buildinfo dpkg-genchanges --build=binary -O../libgridxc_2.1.0-1_amd64.changes dpkg-genchanges: info: binary-only upload (no source code included) dpkg-source --after-build . dpkg-buildpackage: info: binary-only upload (no source included) dpkg-genchanges: info: including full source code in upload I: copying local configuration 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/2896939 and its subdirectories I: Current time: Mon Mar 10 12:57:44 -12 2025 I: pbuilder-time-stamp: 1741654664