Diff of the two buildlogs:

--
--- b1/build.log	2025-03-15 19:05:55.596225094 +0000
+++ b2/build.log	2025-03-15 19:07:22.776281166 +0000
@@ -1,6 +1,6 @@
 I: pbuilder: network access will be disabled during build
-I: Current time: Sat Mar 15 07:03:58 -12 2025
-I: pbuilder-time-stamp: 1742065438
+I: Current time: Sat Apr 18 15:28:58 +14 2026
+I: pbuilder-time-stamp: 1776475738
 I: Building the build Environment
 I: extracting base tarball [/var/cache/pbuilder/trixie-reproducible-base.tgz]
 I: copying local configuration
@@ -24,52 +24,84 @@
 dpkg-source: info: applying cmake_version_tag.patch
 I: using fakeroot in build.
 I: Installing the build-deps
-I: user script /srv/workspace/pbuilder/2896936/tmp/hooks/D02_print_environment starting
+I: user script /srv/workspace/pbuilder/2613561/tmp/hooks/D01_modify_environment starting
+debug: Running on codethink03-arm64.
+I: Changing host+domainname to test build reproducibility
+I: Adding a custom variable just for the fun of it...
+I: Changing /bin/sh to bash
+'/bin/sh' -> '/bin/bash'
+lrwxrwxrwx 1 root root 9 Apr 18 01:29 /bin/sh -> /bin/bash
+I: Setting pbuilder2's login shell to /bin/bash
+I: Setting pbuilder2's GECOS to second user,second room,second work-phone,second home-phone,second other
+I: user script /srv/workspace/pbuilder/2613561/tmp/hooks/D01_modify_environment finished
+I: user script /srv/workspace/pbuilder/2613561/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='arm64'
-  DEBIAN_FRONTEND='noninteractive'
+  BASH=/bin/sh
+  BASHOPTS=checkwinsize:cmdhist:complete_fullquote:extquote:force_fignore:globasciiranges:globskipdots:hostcomplete:interactive_comments:patsub_replacement:progcomp:promptvars:sourcepath
+  BASH_ALIASES=()
+  BASH_ARGC=()
+  BASH_ARGV=()
+  BASH_CMDS=()
+  BASH_LINENO=([0]="12" [1]="0")
+  BASH_LOADABLES_PATH=/usr/local/lib/bash:/usr/lib/bash:/opt/local/lib/bash:/usr/pkg/lib/bash:/opt/pkg/lib/bash:.
+  BASH_SOURCE=([0]="/tmp/hooks/D02_print_environment" [1]="/tmp/hooks/D02_print_environment")
+  BASH_VERSINFO=([0]="5" [1]="2" [2]="37" [3]="1" [4]="release" [5]="aarch64-unknown-linux-gnu")
+  BASH_VERSION='5.2.37(1)-release'
+  BUILDDIR=/build/reproducible-path
+  BUILDUSERGECOS='second user,second room,second work-phone,second home-phone,second other'
+  BUILDUSERNAME=pbuilder2
+  BUILD_ARCH=arm64
+  DEBIAN_FRONTEND=noninteractive
   DEB_BUILD_OPTIONS='buildinfo=+all reproducible=+all parallel=12 '
-  DISTRIBUTION='trixie'
-  HOME='/root'
-  HOST_ARCH='arm64'
+  DIRSTACK=()
+  DISTRIBUTION=trixie
+  EUID=0
+  FUNCNAME=([0]="Echo" [1]="main")
+  GROUPS=()
+  HOME=/root
+  HOSTNAME=i-capture-the-hostname
+  HOSTTYPE=aarch64
+  HOST_ARCH=arm64
   IFS=' 	
   '
-  INVOCATION_ID='6dc94dbcb71f451182ae7cce4cd70261'
-  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='2896936'
-  PS1='# '
-  PS2='> '
+  INVOCATION_ID=d316316f62594f32907eb8e9c1929e37
+  LANG=C
+  LANGUAGE=nl_BE:nl
+  LC_ALL=C
+  MACHTYPE=aarch64-unknown-linux-gnu
+  MAIL=/var/mail/root
+  OPTERR=1
+  OPTIND=1
+  OSTYPE=linux-gnu
+  PATH=/usr/sbin:/usr/bin:/sbin:/bin:/usr/games:/i/capture/the/path
+  PBCURRENTCOMMANDLINEOPERATION=build
+  PBUILDER_OPERATION=build
+  PBUILDER_PKGDATADIR=/usr/share/pbuilder
+  PBUILDER_PKGLIBDIR=/usr/lib/pbuilder
+  PBUILDER_SYSCONFDIR=/etc
+  PIPESTATUS=([0]="0")
+  POSIXLY_CORRECT=y
+  PPID=2613561
   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.vo1CJFXm/pbuilderrc_6mPc --distribution trixie --hookdir /etc/pbuilder/first-build-hooks --debbuildopts -b --basetgz /var/cache/pbuilder/trixie-reproducible-base.tgz --buildresult /srv/reproducible-results/rbuild-debian/r-b-build.vo1CJFXm/b1 --logfile b1/build.log libmbd_0.12.8-2.dsc'
-  SUDO_GID='109'
-  SUDO_UID='104'
-  SUDO_USER='jenkins'
-  TERM='unknown'
-  TZ='/usr/share/zoneinfo/Etc/GMT+12'
-  USER='root'
-  _='/usr/bin/systemd-run'
-  http_proxy='http://192.168.101.4:3128'
+  PWD=/
+  SHELL=/bin/bash
+  SHELLOPTS=braceexpand:errexit:hashall:interactive-comments:posix
+  SHLVL=3
+  SUDO_COMMAND='/usr/bin/timeout -k 24.1h 24h /usr/bin/ionice -c 3 /usr/bin/nice -n 11 /usr/bin/unshare --uts -- /usr/sbin/pbuilder --build --configfile /srv/reproducible-results/rbuild-debian/r-b-build.vo1CJFXm/pbuilderrc_99OX --distribution trixie --hookdir /etc/pbuilder/rebuild-hooks --debbuildopts -b --basetgz /var/cache/pbuilder/trixie-reproducible-base.tgz --buildresult /srv/reproducible-results/rbuild-debian/r-b-build.vo1CJFXm/b2 --logfile b2/build.log libmbd_0.12.8-2.dsc'
+  SUDO_GID=109
+  SUDO_UID=104
+  SUDO_USER=jenkins
+  TERM=unknown
+  TZ=/usr/share/zoneinfo/Etc/GMT-14
+  UID=0
+  USER=root
+  _='I: set'
+  http_proxy=http://192.168.101.4:3128
 I: uname -a
-  Linux codethink04-arm64 6.1.0-32-cloud-arm64 #1 SMP Debian 6.1.129-1 (2025-03-06) aarch64 GNU/Linux
+  Linux i-capture-the-hostname 6.1.0-32-cloud-arm64 #1 SMP Debian 6.1.129-1 (2025-03-06) aarch64 GNU/Linux
 I: ls -l /bin
-  lrwxrwxrwx 1 root root 7 Mar  4 11:20 /bin -> usr/bin
-I: user script /srv/workspace/pbuilder/2896936/tmp/hooks/D02_print_environment finished
+  lrwxrwxrwx 1 root root 7 Mar  4  2025 /bin -> usr/bin
+I: user script /srv/workspace/pbuilder/2613561/tmp/hooks/D02_print_environment finished
  -> Attempting to satisfy build-dependencies
  -> Creating pbuilder-satisfydepends-dummy package
 Package: pbuilder-satisfydepends-dummy
@@ -260,7 +292,7 @@
 Get: 139 http://deb.debian.org/debian trixie/main arm64 openmpi-bin arm64 5.0.7-1 [180 kB]
 Get: 140 http://deb.debian.org/debian trixie/main arm64 libopenmpi-dev arm64 5.0.7-1 [1089 kB]
 Get: 141 http://deb.debian.org/debian trixie/main arm64 mpi-default-dev arm64 1.18 [3372 B]
-Fetched 128 MB in 1s (175 MB/s)
+Fetched 128 MB in 0s (279 MB/s)
 Preconfiguring packages ...
 Selecting previously unselected package libpython3.13-minimal:arm64.
 (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 ... 19917 files and directories currently installed.)
@@ -727,8 +759,8 @@
 Setting up tzdata (2025a-2) ...
 
 Current default time zone: 'Etc/UTC'
-Local time is now:      Sat Mar 15 19:04:46 UTC 2025.
-Universal Time is now:  Sat Mar 15 19:04:46 UTC 2025.
+Local time is now:      Sat Apr 18 01:29:25 UTC 2026.
+Universal Time is now:  Sat Apr 18 01:29:25 UTC 2026.
 Run 'dpkg-reconfigure tzdata' if you wish to change it.
 
 Setting up autotools-dev (20220109.1) ...
@@ -866,7 +898,11 @@
 fakeroot is already the newest version (1.37-1).
 0 upgraded, 0 newly installed, 0 to remove and 0 not upgraded.
 I: Building the package
-I: Running cd /build/reproducible-path/libmbd-0.12.8/ && 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  > ../libmbd_0.12.8-2_source.changes
+I: user script /srv/workspace/pbuilder/2613561/tmp/hooks/A99_set_merged_usr starting
+Not re-configuring usrmerge for trixie
+I: user script /srv/workspace/pbuilder/2613561/tmp/hooks/A99_set_merged_usr finished
+hostname: Name or service not known
+I: Running cd /build/reproducible-path/libmbd-0.12.8/ && env PATH="/usr/sbin:/usr/bin:/sbin:/bin:/usr/games:/i/capture/the/path" HOME="/nonexistent/second-build" dpkg-buildpackage -us -uc -b && env PATH="/usr/sbin:/usr/bin:/sbin:/bin:/usr/games:/i/capture/the/path" HOME="/nonexistent/second-build" dpkg-genchanges -S  > ../libmbd_0.12.8-2_source.changes
 dpkg-buildpackage: info: source package libmbd
 dpkg-buildpackage: info: source version 0.12.8-2
 dpkg-buildpackage: info: source distribution unstable
@@ -913,7 +949,7 @@
 -- Looking for Fortran cheev
 -- Looking for Fortran cheev - found
 -- Found LAPACK: /usr/lib/aarch64-linux-gnu/liblapack.so;/usr/lib/aarch64-linux-gnu/libblas.so
--- Configuring done (4.3s)
+-- Configuring done (2.2s)
 -- Generating done (0.0s)
 CMake Warning:
   Manually-specified variables were not used by the project:
@@ -941,20 +977,20 @@
 make[3]: Leaving directory '/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu'
 make  -f src/CMakeFiles/mbd.dir/build.make src/CMakeFiles/mbd.dir/build
 make[3]: Entering directory '/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu'
-[  3%] Building Fortran object src/CMakeFiles/mbd.dir/mbd_constants.f90.o
-cd /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/src && /usr/bin/f95  -I/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/src/modules -g -O2 -ffile-prefix-map=/build/reproducible-path/libmbd-0.12.8=. -fstack-protector-strong -fstack-clash-protection -mbranch-protection=standard -fall-intrinsics -std=f2008ts -pedantic -Wall -Wcharacter-truncation -Wimplicit-procedure -Wextra -Wno-maybe-uninitialized -O3 -Jmodules -c /build/reproducible-path/libmbd-0.12.8/src/mbd_constants.f90 -o CMakeFiles/mbd.dir/mbd_constants.f90.o
-[  7%] Building Fortran object src/CMakeFiles/mbd.dir/mbd_version.f90.o
+[  3%] Building Fortran object src/CMakeFiles/mbd.dir/mbd_version.f90.o
+[  7%] Building Fortran object src/CMakeFiles/mbd.dir/mbd_constants.f90.o
 cd /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/src && /usr/bin/f95  -I/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/src/modules -g -O2 -ffile-prefix-map=/build/reproducible-path/libmbd-0.12.8=. -fstack-protector-strong -fstack-clash-protection -mbranch-protection=standard -fall-intrinsics -std=f2008ts -pedantic -Wall -Wcharacter-truncation -Wimplicit-procedure -Wextra -Wno-maybe-uninitialized -O3 -Jmodules -c /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/src/mbd_version.f90 -o CMakeFiles/mbd.dir/mbd_version.f90.o
-/usr/bin/cmake -E cmake_copy_f90_mod src/modules/mbd_constants.mod src/CMakeFiles/mbd.dir/mbd_constants.mod.stamp GNU
+cd /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/src && /usr/bin/f95  -I/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/src/modules -g -O2 -ffile-prefix-map=/build/reproducible-path/libmbd-0.12.8=. -fstack-protector-strong -fstack-clash-protection -mbranch-protection=standard -fall-intrinsics -std=f2008ts -pedantic -Wall -Wcharacter-truncation -Wimplicit-procedure -Wextra -Wno-maybe-uninitialized -O3 -Jmodules -c /build/reproducible-path/libmbd-0.12.8/src/mbd_constants.f90 -o CMakeFiles/mbd.dir/mbd_constants.f90.o
 /usr/bin/cmake -E cmake_copy_f90_mod src/modules/mbd_version.mod src/CMakeFiles/mbd.dir/mbd_version.mod.stamp GNU
+/usr/bin/cmake -E cmake_copy_f90_mod src/modules/mbd_constants.mod src/CMakeFiles/mbd.dir/mbd_constants.mod.stamp GNU
+/usr/bin/cmake -E touch src/CMakeFiles/mbd.dir/mbd_version.f90.o.provides.build
 /usr/bin/cmake -E touch src/CMakeFiles/mbd.dir/mbd_constants.f90.o.provides.build
-[ 10%] Building Fortran object src/CMakeFiles/mbd.dir/mbd_defaults.f90.o
-cd /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/src && /usr/bin/f95  -I/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/src/modules -g -O2 -ffile-prefix-map=/build/reproducible-path/libmbd-0.12.8=. -fstack-protector-strong -fstack-clash-protection -mbranch-protection=standard -fall-intrinsics -std=f2008ts -pedantic -Wall -Wcharacter-truncation -Wimplicit-procedure -Wextra -Wno-maybe-uninitialized -O3 -Jmodules -c /build/reproducible-path/libmbd-0.12.8/src/mbd_defaults.f90 -o CMakeFiles/mbd.dir/mbd_defaults.f90.o
-[ 14%] Building Fortran object src/CMakeFiles/mbd.dir/mbd_gradients.f90.o
+[ 10%] Building Fortran object src/CMakeFiles/mbd.dir/mbd_gradients.f90.o
+[ 14%] Building Fortran object src/CMakeFiles/mbd.dir/mbd_defaults.f90.o
 cd /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/src && /usr/bin/f95  -I/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/src/modules -g -O2 -ffile-prefix-map=/build/reproducible-path/libmbd-0.12.8=. -fstack-protector-strong -fstack-clash-protection -mbranch-protection=standard -fall-intrinsics -std=f2008ts -pedantic -Wall -Wcharacter-truncation -Wimplicit-procedure -Wextra -Wno-maybe-uninitialized -O3 -Jmodules -c /build/reproducible-path/libmbd-0.12.8/src/mbd_gradients.f90 -o CMakeFiles/mbd.dir/mbd_gradients.f90.o
 [ 17%] Building Fortran object src/CMakeFiles/mbd.dir/mbd_linalg.F90.o
+cd /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/src && /usr/bin/f95  -I/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/src/modules -g -O2 -ffile-prefix-map=/build/reproducible-path/libmbd-0.12.8=. -fstack-protector-strong -fstack-clash-protection -mbranch-protection=standard -fall-intrinsics -std=f2008ts -pedantic -Wall -Wcharacter-truncation -Wimplicit-procedure -Wextra -Wno-maybe-uninitialized -O3 -Jmodules -c /build/reproducible-path/libmbd-0.12.8/src/mbd_defaults.f90 -o CMakeFiles/mbd.dir/mbd_defaults.f90.o
 cd /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/src && /usr/bin/f95  -I/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/src/modules -g -O2 -ffile-prefix-map=/build/reproducible-path/libmbd-0.12.8=. -fstack-protector-strong -fstack-clash-protection -mbranch-protection=standard -fall-intrinsics -std=f2008ts -pedantic -Wall -Wcharacter-truncation -Wimplicit-procedure -Wextra -Wno-maybe-uninitialized -O3 -Jmodules -c /build/reproducible-path/libmbd-0.12.8/src/mbd_linalg.F90 -o CMakeFiles/mbd.dir/mbd_linalg.F90.o
-/usr/bin/cmake -E touch src/CMakeFiles/mbd.dir/mbd_version.f90.o.provides.build
 /usr/bin/cmake -E cmake_copy_f90_mod src/modules/mbd_defaults.mod src/CMakeFiles/mbd.dir/mbd_defaults.mod.stamp GNU
 /usr/bin/cmake -E touch src/CMakeFiles/mbd.dir/mbd_defaults.f90.o.provides.build
 /usr/bin/cmake -E cmake_copy_f90_mod src/modules/mbd_linalg.mod src/CMakeFiles/mbd.dir/mbd_linalg.mod.stamp GNU
@@ -964,14 +1000,14 @@
 [ 21%] Building Fortran object src/CMakeFiles/mbd.dir/mbd_utils.F90.o
 cd /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/src && /usr/bin/f95  -I/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/src/modules -g -O2 -ffile-prefix-map=/build/reproducible-path/libmbd-0.12.8=. -fstack-protector-strong -fstack-clash-protection -mbranch-protection=standard -fall-intrinsics -std=f2008ts -pedantic -Wall -Wcharacter-truncation -Wimplicit-procedure -Wextra -Wno-maybe-uninitialized -O3 -Jmodules -c /build/reproducible-path/libmbd-0.12.8/src/mbd_utils.F90 -o CMakeFiles/mbd.dir/mbd_utils.F90.o
 /usr/bin/cmake -E cmake_copy_f90_mod src/modules/mbd_utils.mod src/CMakeFiles/mbd.dir/mbd_utils.mod.stamp GNU
-/usr/bin/cmake -E touch src/CMakeFiles/mbd.dir/mbd_utils.F90.o.provides.build
-[ 25%] Building Fortran object src/CMakeFiles/mbd.dir/mbd_damping.F90.o
+[ 25%] Building Fortran object src/CMakeFiles/mbd.dir/mbd_lapack.f90.o
 [ 28%] Building Fortran object src/CMakeFiles/mbd.dir/mbd_formulas.f90.o
+[ 32%] Building Fortran object src/CMakeFiles/mbd.dir/mbd_damping.F90.o
 cd /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/src && /usr/bin/f95  -I/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/src/modules -g -O2 -ffile-prefix-map=/build/reproducible-path/libmbd-0.12.8=. -fstack-protector-strong -fstack-clash-protection -mbranch-protection=standard -fall-intrinsics -std=f2008ts -pedantic -Wall -Wcharacter-truncation -Wimplicit-procedure -Wextra -Wno-maybe-uninitialized -O3 -Jmodules -c /build/reproducible-path/libmbd-0.12.8/src/mbd_damping.F90 -o CMakeFiles/mbd.dir/mbd_damping.F90.o
-[ 32%] Building Fortran object src/CMakeFiles/mbd.dir/mbd_lapack.f90.o
 cd /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/src && /usr/bin/f95  -I/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/src/modules -g -O2 -ffile-prefix-map=/build/reproducible-path/libmbd-0.12.8=. -fstack-protector-strong -fstack-clash-protection -mbranch-protection=standard -fall-intrinsics -std=f2008ts -pedantic -Wall -Wcharacter-truncation -Wimplicit-procedure -Wextra -Wno-maybe-uninitialized -O3 -Jmodules -c /build/reproducible-path/libmbd-0.12.8/src/mbd_formulas.f90 -o CMakeFiles/mbd.dir/mbd_formulas.f90.o
-[ 35%] Building Fortran object src/CMakeFiles/mbd.dir/mbd_vdw_param.f90.o
 cd /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/src && /usr/bin/f95  -I/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/src/modules -g -O2 -ffile-prefix-map=/build/reproducible-path/libmbd-0.12.8=. -fstack-protector-strong -fstack-clash-protection -mbranch-protection=standard -fall-intrinsics -std=f2008ts -pedantic -Wall -Wcharacter-truncation -Wimplicit-procedure -Wextra -Wno-maybe-uninitialized -O3 -Jmodules -c /build/reproducible-path/libmbd-0.12.8/src/mbd_lapack.f90 -o CMakeFiles/mbd.dir/mbd_lapack.f90.o
+/usr/bin/cmake -E touch src/CMakeFiles/mbd.dir/mbd_utils.F90.o.provides.build
+[ 35%] Building Fortran object src/CMakeFiles/mbd.dir/mbd_vdw_param.f90.o
 cd /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/src && /usr/bin/f95  -I/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/src/modules -g -O2 -ffile-prefix-map=/build/reproducible-path/libmbd-0.12.8=. -fstack-protector-strong -fstack-clash-protection -mbranch-protection=standard -fall-intrinsics -std=f2008ts -pedantic -Wall -Wcharacter-truncation -Wimplicit-procedure -Wextra -Wno-maybe-uninitialized -O3 -Jmodules -c /build/reproducible-path/libmbd-0.12.8/src/mbd_vdw_param.f90 -o CMakeFiles/mbd.dir/mbd_vdw_param.f90.o
 /usr/bin/cmake -E cmake_copy_f90_mod src/modules/mbd_vdw_param.mod src/CMakeFiles/mbd.dir/mbd_vdw_param.mod.stamp GNU
 /usr/bin/cmake -E touch src/CMakeFiles/mbd.dir/mbd_vdw_param.f90.o.provides.build
@@ -1013,9 +1049,9 @@
 /usr/bin/cmake -E cmake_copy_f90_mod src/modules/mbd_geom.mod src/CMakeFiles/mbd.dir/mbd_geom.mod.stamp GNU
 /usr/bin/cmake -E touch src/CMakeFiles/mbd.dir/mbd_geom.F90.o.provides.build
 [ 46%] Building Fortran object src/CMakeFiles/mbd.dir/mbd_ts.F90.o
-cd /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/src && /usr/bin/f95  -I/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/src/modules -g -O2 -ffile-prefix-map=/build/reproducible-path/libmbd-0.12.8=. -fstack-protector-strong -fstack-clash-protection -mbranch-protection=standard -fall-intrinsics -std=f2008ts -pedantic -Wall -Wcharacter-truncation -Wimplicit-procedure -Wextra -Wno-maybe-uninitialized -O3 -Jmodules -c /build/reproducible-path/libmbd-0.12.8/src/mbd_ts.F90 -o CMakeFiles/mbd.dir/mbd_ts.F90.o
 [ 50%] Building Fortran object src/CMakeFiles/mbd.dir/mbd_density.f90.o
 cd /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/src && /usr/bin/f95  -I/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/src/modules -g -O2 -ffile-prefix-map=/build/reproducible-path/libmbd-0.12.8=. -fstack-protector-strong -fstack-clash-protection -mbranch-protection=standard -fall-intrinsics -std=f2008ts -pedantic -Wall -Wcharacter-truncation -Wimplicit-procedure -Wextra -Wno-maybe-uninitialized -O3 -Jmodules -c /build/reproducible-path/libmbd-0.12.8/src/mbd_density.f90 -o CMakeFiles/mbd.dir/mbd_density.f90.o
+cd /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/src && /usr/bin/f95  -I/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/src/modules -g -O2 -ffile-prefix-map=/build/reproducible-path/libmbd-0.12.8=. -fstack-protector-strong -fstack-clash-protection -mbranch-protection=standard -fall-intrinsics -std=f2008ts -pedantic -Wall -Wcharacter-truncation -Wimplicit-procedure -Wextra -Wno-maybe-uninitialized -O3 -Jmodules -c /build/reproducible-path/libmbd-0.12.8/src/mbd_ts.F90 -o CMakeFiles/mbd.dir/mbd_ts.F90.o
 /build/reproducible-path/libmbd-0.12.8/src/mbd_density.f90:46:68:
 
    46 |     omegas_p = matmul(matmul(modes, diag(omegas)), transpose(modes))
@@ -1066,24 +1102,24 @@
    74 | end module
       |          ^
 note: '__var_3_mmb' declared here
+/usr/bin/cmake -E cmake_copy_f90_mod src/modules/mbd_ts.mod src/CMakeFiles/mbd.dir/mbd_ts.mod.stamp GNU
+/usr/bin/cmake -E touch src/CMakeFiles/mbd.dir/mbd_ts.F90.o.provides.build
+/usr/bin/cmake -E cmake_copy_f90_mod src/modules/mbd_density.mod src/CMakeFiles/mbd.dir/mbd_density.mod.stamp GNU
+/usr/bin/cmake -E touch src/CMakeFiles/mbd.dir/mbd_density.f90.o.provides.build
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 [ 53%] Building Fortran object src/CMakeFiles/mbd.dir/mbd_dipole.F90.o
 cd /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/src && /usr/bin/f95  -I/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/src/modules -g -O2 -ffile-prefix-map=/build/reproducible-path/libmbd-0.12.8=. -fstack-protector-strong -fstack-clash-protection -mbranch-protection=standard -fall-intrinsics -std=f2008ts -pedantic -Wall -Wcharacter-truncation -Wimplicit-procedure -Wextra -Wno-maybe-uninitialized -O3 -Jmodules -c /build/reproducible-path/libmbd-0.12.8/src/mbd_dipole.F90 -o CMakeFiles/mbd.dir/mbd_dipole.F90.o
-/usr/bin/cmake -E cmake_copy_f90_mod src/modules/mbd_density.mod src/CMakeFiles/mbd.dir/mbd_density.mod.stamp GNU
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-/usr/bin/cmake -E cmake_copy_f90_mod src/modules/mbd_ts.mod src/CMakeFiles/mbd.dir/mbd_ts.mod.stamp GNU
-/usr/bin/cmake -E touch src/CMakeFiles/mbd.dir/mbd_ts.F90.o.provides.build
 /usr/bin/cmake -E cmake_copy_f90_mod src/modules/mbd_dipole.mod src/CMakeFiles/mbd.dir/mbd_dipole.mod.stamp GNU
-[ 57%] Building Fortran object src/CMakeFiles/mbd.dir/mbd_hamiltonian.F90.o
-[ 60%] Building Fortran object src/CMakeFiles/mbd.dir/mbd_rpa.F90.o
-[ 64%] Building Fortran object src/CMakeFiles/mbd.dir/mbd_scs.f90.o
-cd /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/src && /usr/bin/f95  -I/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/src/modules -g -O2 -ffile-prefix-map=/build/reproducible-path/libmbd-0.12.8=. -fstack-protector-strong -fstack-clash-protection -mbranch-protection=standard -fall-intrinsics -std=f2008ts -pedantic -Wall -Wcharacter-truncation -Wimplicit-procedure -Wextra -Wno-maybe-uninitialized -O3 -Jmodules -c /build/reproducible-path/libmbd-0.12.8/src/mbd_hamiltonian.F90 -o CMakeFiles/mbd.dir/mbd_hamiltonian.F90.o
-cd /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/src && /usr/bin/f95  -I/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/src/modules -g -O2 -ffile-prefix-map=/build/reproducible-path/libmbd-0.12.8=. -fstack-protector-strong -fstack-clash-protection -mbranch-protection=standard -fall-intrinsics -std=f2008ts -pedantic -Wall -Wcharacter-truncation -Wimplicit-procedure -Wextra -Wno-maybe-uninitialized -O3 -Jmodules -c /build/reproducible-path/libmbd-0.12.8/src/mbd_rpa.F90 -o CMakeFiles/mbd.dir/mbd_rpa.F90.o
-[ 67%] Building Fortran object src/CMakeFiles/mbd.dir/mbd_coulomb.f90.o
+/usr/bin/cmake -E touch src/CMakeFiles/mbd.dir/mbd_dipole.F90.o.provides.build
+[ 60%] Building Fortran object src/CMakeFiles/mbd.dir/mbd_scs.f90.o
+[ 64%] Building Fortran object src/CMakeFiles/mbd.dir/mbd_hamiltonian.F90.o
+[ 64%] Building Fortran object src/CMakeFiles/mbd.dir/mbd_coulomb.f90.o
+[ 67%] Building Fortran object src/CMakeFiles/mbd.dir/mbd_rpa.F90.o
 cd /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/src && /usr/bin/f95  -I/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/src/modules -g -O2 -ffile-prefix-map=/build/reproducible-path/libmbd-0.12.8=. -fstack-protector-strong -fstack-clash-protection -mbranch-protection=standard -fall-intrinsics -std=f2008ts -pedantic -Wall -Wcharacter-truncation -Wimplicit-procedure -Wextra -Wno-maybe-uninitialized -O3 -Jmodules -c /build/reproducible-path/libmbd-0.12.8/src/mbd_scs.f90 -o CMakeFiles/mbd.dir/mbd_scs.f90.o
+cd /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/src && /usr/bin/f95  -I/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/src/modules -g -O2 -ffile-prefix-map=/build/reproducible-path/libmbd-0.12.8=. -fstack-protector-strong -fstack-clash-protection -mbranch-protection=standard -fall-intrinsics -std=f2008ts -pedantic -Wall -Wcharacter-truncation -Wimplicit-procedure -Wextra -Wno-maybe-uninitialized -O3 -Jmodules -c /build/reproducible-path/libmbd-0.12.8/src/mbd_hamiltonian.F90 -o CMakeFiles/mbd.dir/mbd_hamiltonian.F90.o
 cd /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/src && /usr/bin/f95  -I/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/src/modules -g -O2 -ffile-prefix-map=/build/reproducible-path/libmbd-0.12.8=. -fstack-protector-strong -fstack-clash-protection -mbranch-protection=standard -fall-intrinsics -std=f2008ts -pedantic -Wall -Wcharacter-truncation -Wimplicit-procedure -Wextra -Wno-maybe-uninitialized -O3 -Jmodules -c /build/reproducible-path/libmbd-0.12.8/src/mbd_coulomb.f90 -o CMakeFiles/mbd.dir/mbd_coulomb.f90.o
-/usr/bin/cmake -E touch src/CMakeFiles/mbd.dir/mbd_dipole.F90.o.provides.build
+cd /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/src && /usr/bin/f95  -I/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/src/modules -g -O2 -ffile-prefix-map=/build/reproducible-path/libmbd-0.12.8=. -fstack-protector-strong -fstack-clash-protection -mbranch-protection=standard -fall-intrinsics -std=f2008ts -pedantic -Wall -Wcharacter-truncation -Wimplicit-procedure -Wextra -Wno-maybe-uninitialized -O3 -Jmodules -c /build/reproducible-path/libmbd-0.12.8/src/mbd_rpa.F90 -o CMakeFiles/mbd.dir/mbd_rpa.F90.o
 /usr/bin/cmake -E cmake_copy_f90_mod src/modules/mbd_rpa.mod src/CMakeFiles/mbd.dir/mbd_rpa.mod.stamp GNU
 /usr/bin/cmake -E touch src/CMakeFiles/mbd.dir/mbd_rpa.F90.o.provides.build
 /usr/bin/cmake -E cmake_copy_f90_mod src/modules/mbd_scs.mod src/CMakeFiles/mbd.dir/mbd_scs.mod.stamp GNU
@@ -1147,26 +1183,26 @@
 make[3]: Leaving directory '/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu'
 [ 82%] Built target mbd
 make  -f tests/CMakeFiles/mbd_grad_tests.dir/build.make tests/CMakeFiles/mbd_grad_tests.dir/depend
+make  -f tests/CMakeFiles/mbd_api_tests.dir/build.make tests/CMakeFiles/mbd_api_tests.dir/depend
 make[3]: Entering directory '/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu'
 cd /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libmbd-0.12.8 /build/reproducible-path/libmbd-0.12.8/tests /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/tests /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/tests/CMakeFiles/mbd_grad_tests.dir/DependInfo.cmake "--color="
-make  -f tests/CMakeFiles/mbd_api_tests.dir/build.make tests/CMakeFiles/mbd_api_tests.dir/depend
 make[3]: Entering directory '/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu'
 cd /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libmbd-0.12.8 /build/reproducible-path/libmbd-0.12.8/tests /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/tests /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/tests/CMakeFiles/mbd_api_tests.dir/DependInfo.cmake "--color="
+Dependee "/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/tests/CMakeFiles/mbd_api_tests.dir/DependInfo.cmake" is newer than depender "/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/tests/CMakeFiles/mbd_api_tests.dir/depend.internal".
 Dependee "/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/tests/CMakeFiles/mbd_grad_tests.dir/DependInfo.cmake" is newer than depender "/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/tests/CMakeFiles/mbd_grad_tests.dir/depend.internal".
 Dependee "/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/tests/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/tests/CMakeFiles/mbd_grad_tests.dir/depend.internal".
-Dependee "/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/tests/CMakeFiles/mbd_api_tests.dir/DependInfo.cmake" is newer than depender "/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/tests/CMakeFiles/mbd_api_tests.dir/depend.internal".
-Scanning dependencies of target mbd_grad_tests
-make[3]: Leaving directory '/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu'
 Dependee "/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/tests/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/tests/CMakeFiles/mbd_api_tests.dir/depend.internal".
-make  -f tests/CMakeFiles/mbd_grad_tests.dir/build.make tests/CMakeFiles/mbd_grad_tests.dir/build
 Scanning dependencies of target mbd_api_tests
 make[3]: Leaving directory '/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu'
 make  -f tests/CMakeFiles/mbd_api_tests.dir/build.make tests/CMakeFiles/mbd_api_tests.dir/build
+Scanning dependencies of target mbd_grad_tests
 make[3]: Entering directory '/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu'
+make[3]: Leaving directory '/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu'
+make  -f tests/CMakeFiles/mbd_grad_tests.dir/build.make tests/CMakeFiles/mbd_grad_tests.dir/build
 make[3]: Entering directory '/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu'
 [ 85%] Building Fortran object tests/CMakeFiles/mbd_grad_tests.dir/mbd_grad_test_cases.F90.o
-[ 89%] Building Fortran object tests/CMakeFiles/mbd_api_tests.dir/mbd_api_tests.F90.o
 cd /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/tests && /usr/bin/f95  -I/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/src -I/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/src/modules -g -O2 -ffile-prefix-map=/build/reproducible-path/libmbd-0.12.8=. -fstack-protector-strong -fstack-clash-protection -mbranch-protection=standard -fall-intrinsics -std=f2008ts -pedantic -Wall -Wcharacter-truncation -Wimplicit-procedure -Wextra -Wno-maybe-uninitialized -O3 -c /build/reproducible-path/libmbd-0.12.8/tests/mbd_grad_test_cases.F90 -o CMakeFiles/mbd_grad_tests.dir/mbd_grad_test_cases.F90.o
+[ 89%] Building Fortran object tests/CMakeFiles/mbd_api_tests.dir/mbd_api_tests.F90.o
 cd /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/tests && /usr/bin/f95  -I/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/src -I/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/src/modules -g -O2 -ffile-prefix-map=/build/reproducible-path/libmbd-0.12.8=. -fstack-protector-strong -fstack-clash-protection -mbranch-protection=standard -fall-intrinsics -std=f2008ts -pedantic -Wall -Wcharacter-truncation -Wimplicit-procedure -Wextra -Wno-maybe-uninitialized -O3 -c /build/reproducible-path/libmbd-0.12.8/tests/mbd_api_tests.F90 -o CMakeFiles/mbd_api_tests.dir/mbd_api_tests.F90.o
 [ 92%] Linking Fortran executable mbd_api_tests
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@@ -1284,30 +1320,24 @@
 6: diff: 0.483E-08, threshold: 0.100E-07: 
 7:  Frequency grid relative error: 0.12425793727288692E-009                          
 7:  Will use parallel mode: atoms     
-7: diff: 0.985E-08, threshold: 0.200E-07: 
 8:  Frequency grid relative error: 0.12425793727288692E-009                          
 8:  Will use parallel mode: atoms     
-8: diff: 0.757E-06, threshold: 0.100E-05: 
 9:  Frequency grid relative error: 0.12425793727288692E-009                          
 9:  Will use parallel mode: atoms     
-9: diff: 0.525E-05, threshold: 0.100E-04: 
 10:  Frequency grid relative error: 0.12425793727288692E-009                          
 10:  Will use parallel mode: atoms     
 10: diff: 0.228E-05, threshold: 0.100E-04: 
 11:  Frequency grid relative error: 0.12425793727288692E-009                          
 11:  Will use parallel mode: atoms     
-11: diff: 0.537E-05, threshold: 0.100E-04: 
- 1/42 Test  #1: grad/T_bare_deriv .......................   Passed    0.12 sec
- 2/42 Test  #2: grad/T_GG_deriv_expl ....................   Passed    0.12 sec
- 3/42 Test  #3: grad/T_GG_deriv_impl ....................   Passed    0.11 sec
- 4/42 Test  #4: grad/T_fermi_deriv_impl .................   Passed    0.11 sec
- 5/42 Test  #5: grad/T_erfc_deriv_expl ..................   Passed    0.10 sec
- 6/42 Test  #6: grad/mbd_deriv_expl .....................   Passed    0.08 sec
- 7/42 Test  #7: grad/mbd_ewald_deriv_expl ...............   Passed    0.07 sec
- 8/42 Test  #8: grad/mbd_ewald_deriv_impl_q .............   Passed    0.06 sec
- 9/42 Test  #9: grad/mbd_ewald_deriv_stress .............   Passed    0.04 sec
-10/42 Test #10: grad/scs_deriv_expl .....................   Passed    0.03 sec
-11/42 Test #11: grad/scs_ewald_deriv_expl ...............   Passed    0.02 sec
+ 1/42 Test  #1: grad/T_bare_deriv .......................   Passed    0.04 sec
+ 2/42 Test  #2: grad/T_GG_deriv_expl ....................   Passed    0.04 sec
+ 3/42 Test  #3: grad/T_GG_deriv_impl ....................   Passed    0.03 sec
+ 4/42 Test  #4: grad/T_fermi_deriv_impl .................   Passed    0.03 sec
+ 5/42 Test  #5: grad/T_erfc_deriv_expl ..................   Passed    0.03 sec
+ 6/42 Test  #6: grad/mbd_deriv_expl .....................   Passed    0.03 sec
+ 7/42 Test #10: grad/scs_deriv_expl .....................   Passed    0.01 sec
+8: diff: 0.757E-06, threshold: 0.100E-05: 
+ 8/42 Test  #8: grad/mbd_ewald_deriv_impl_q .............   Passed    0.02 sec
 12:  Frequency grid relative error: 0.12425793727288692E-009                          
 12:  Will use parallel mode: atoms     
 test 13
@@ -1352,12 +1382,39 @@
 19: Test command: /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/tests/mbd_grad_tests "mbd_rsscs_deriv_expl"
 19: Working Directory: /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/tests
 19: Test timeout computed to be: 1500
+12: diff: 0.279E-04, threshold: 0.100E-03: 
+ 9/42 Test #12: grad/scs_ewald_deriv_stress .............   Passed    0.03 sec
 test 20
       Start 20: grad/mbd_rsscs_ewald_deriv_expl
 
 20: Test command: /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/tests/mbd_grad_tests "mbd_rsscs_ewald_deriv_expl"
 20: Working Directory: /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/tests
 20: Test timeout computed to be: 1500
+11: diff: 0.537E-05, threshold: 0.100E-04: 
+10/42 Test #11: grad/scs_ewald_deriv_expl ...............   Passed    0.04 sec
+7: diff: 0.985E-08, threshold: 0.200E-07: 
+11/42 Test  #7: grad/mbd_ewald_deriv_expl ...............   Passed    0.05 sec
+13:  Frequency grid relative error: 0.12425793727288692E-009                          
+13:  Will use parallel mode: atoms     
+13: diff: 0.200E-09, threshold: 0.100E-05: 
+12/42 Test #13: grad/mbd_deriv_impl_alpha ...............   Passed    0.02 sec
+14:  Frequency grid relative error: 0.12425793727288692E-009                          
+14:  Will use parallel mode: atoms     
+14: diff: 0.359E-11, threshold: 0.100E-05: 
+13/42 Test #14: grad/mbd_ewald_deriv_impl_alpha .........   Passed    0.02 sec
+15:  Frequency grid relative error: 0.12425793727288692E-009                          
+15:  Will use parallel mode: atoms     
+15: diff: 0.389E-08, threshold: 0.200E-07: 
+14/42 Test #15: grad/mbd_deriv_impl_omega ...............   Passed    0.02 sec
+16:  Frequency grid relative error: 0.12425793727288692E-009                          
+16:  Will use parallel mode: atoms     
+16: diff: 0.188E-08, threshold: 0.200E-07: 
+17:  Frequency grid relative error: 0.12425793727288692E-009                          
+17:  Will use parallel mode: atoms     
+17: diff: 0.649E-09, threshold: 0.100E-07: 
+15/42 Test #17: grad/mbd_deriv_impl_vdw .................   Passed    0.01 sec
+18:  Frequency grid relative error: 0.12425793727288692E-009                          
+18:  Will use parallel mode: atoms     
 test 21
       Start 21: grad/mbd_rsscs_ewald_deriv_stress
 
@@ -1376,48 +1433,6 @@
 23: Test command: /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/tests/mbd_grad_tests "mbd_rsscs_deriv_impl_C6"
 23: Working Directory: /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/tests
 23: Test timeout computed to be: 1500
-12: diff: 0.279E-04, threshold: 0.100E-03: 
-13:  Frequency grid relative error: 0.12425793727288692E-009                          
-13:  Will use parallel mode: atoms     
-13: diff: 0.200E-09, threshold: 0.100E-05: 
-14:  Frequency grid relative error: 0.12425793727288692E-009                          
-14:  Will use parallel mode: atoms     
-14: diff: 0.359E-11, threshold: 0.100E-05: 
-15:  Frequency grid relative error: 0.12425793727288692E-009                          
-15:  Will use parallel mode: atoms     
-15: diff: 0.389E-08, threshold: 0.200E-07: 
-16:  Frequency grid relative error: 0.12425793727288692E-009                          
-16:  Will use parallel mode: atoms     
-16: diff: 0.188E-08, threshold: 0.200E-07: 
-17:  Frequency grid relative error: 0.12425793727288692E-009                          
-17:  Will use parallel mode: atoms     
-17: diff: 0.649E-09, threshold: 0.100E-07: 
-18:  Frequency grid relative error: 0.12425793727288692E-009                          
-18:  Will use parallel mode: atoms     
-18: diff: 0.190E-09, threshold: 0.100E-07: 
-19:  Frequency grid relative error: 0.12425793727288692E-009                          
-19:  Will use parallel mode: atoms     
-19: diff: 0.191E-08, threshold: 0.100E-07: 
-20:  Frequency grid relative error: 0.12425793727288692E-009                          
-20:  Will use parallel mode: atoms     
-21:  Frequency grid relative error: 0.12425793727288692E-009                          
-21:  Will use parallel mode: atoms     
-22:  Frequency grid relative error: 0.12425793727288692E-009                          
-22:  Will use parallel mode: atoms     
-22: diff: 0.178E-07, threshold: 0.100E-06: 
-23:  Frequency grid relative error: 0.12425793727288692E-009                          
-23:  Will use parallel mode: atoms     
-23: diff: 0.256E-07, threshold: 0.500E-07: 
-12/42 Test #12: grad/scs_ewald_deriv_stress .............   Passed    0.13 sec
-13/42 Test #13: grad/mbd_deriv_impl_alpha ...............   Passed    0.12 sec
-14/42 Test #14: grad/mbd_ewald_deriv_impl_alpha .........   Passed    0.11 sec
-15/42 Test #15: grad/mbd_deriv_impl_omega ...............   Passed    0.10 sec
-16/42 Test #16: grad/mbd_ewald_deriv_impl_omega .........   Passed    0.09 sec
-17/42 Test #17: grad/mbd_deriv_impl_vdw .................   Passed    0.09 sec
-18/42 Test #18: grad/mbd_ewald_deriv_impl_vdw ...........   Passed    0.08 sec
-19/42 Test #19: grad/mbd_rsscs_deriv_expl ...............   Passed    0.07 sec
-20/42 Test #22: grad/mbd_rsscs_deriv_impl_alpha .........   Passed    0.04 sec
-21/42 Test #23: grad/mbd_rsscs_deriv_impl_C6 ............   Passed    0.02 sec
 test 24
       Start 24: grad/mbd_rsscs_deriv_impl_vdw
 
@@ -1442,12 +1457,41 @@
 27: Test command: /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/tests/mbd_grad_tests "mbd_rsscs_ewald_deriv_impl_vdw"
 27: Working Directory: /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/tests
 27: Test timeout computed to be: 1500
+19:  Frequency grid relative error: 0.12425793727288692E-009                          
+19:  Will use parallel mode: atoms     
+19: diff: 0.191E-08, threshold: 0.100E-07: 
+9: diff: 0.525E-05, threshold: 0.100E-04: 
+20:  Frequency grid relative error: 0.12425793727288692E-009                          
+20:  Will use parallel mode: atoms     
+16/42 Test #16: grad/mbd_ewald_deriv_impl_omega .........   Passed    0.04 sec
 test 28
       Start 28: grad/ts_deriv_expl
 
 28: Test command: /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/tests/mbd_grad_tests "ts_deriv_expl"
 28: Working Directory: /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/tests
 28: Test timeout computed to be: 1500
+17/42 Test #19: grad/mbd_rsscs_deriv_expl ...............   Passed    0.03 sec
+18/42 Test  #9: grad/mbd_ewald_deriv_stress .............   Passed    0.07 sec
+18: diff: 0.190E-09, threshold: 0.100E-07: 
+19/42 Test #18: grad/mbd_ewald_deriv_impl_vdw ...........   Passed    0.04 sec
+21:  Frequency grid relative error: 0.12425793727288692E-009                          
+21:  Will use parallel mode: atoms     
+22:  Frequency grid relative error: 0.12425793727288692E-009                          
+22:  Will use parallel mode: atoms     
+22: diff: 0.178E-07, threshold: 0.100E-06: 
+20/42 Test #22: grad/mbd_rsscs_deriv_impl_alpha .........   Passed    0.02 sec
+23:  Frequency grid relative error: 0.12425793727288692E-009                          
+23:  Will use parallel mode: atoms     
+23: diff: 0.256E-07, threshold: 0.500E-07: 
+21/42 Test #23: grad/mbd_rsscs_deriv_impl_C6 ............   Passed    0.02 sec
+24:  Frequency grid relative error: 0.12425793727288692E-009                          
+24:  Will use parallel mode: atoms     
+24: diff: 0.140E-09, threshold: 0.100E-07: 
+22/42 Test #24: grad/mbd_rsscs_deriv_impl_vdw ...........   Passed    0.02 sec
+25:  Frequency grid relative error: 0.12425793727288692E-009                          
+25:  Will use parallel mode: atoms     
+26:  Frequency grid relative error: 0.12425793727288692E-009                          
+26:  Will use parallel mode: atoms     
 test 29
       Start 29: grad/ts_ewald_deriv_expl
 
@@ -1478,58 +1522,46 @@
 33: Test command: /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/tests/mbd_grad_tests "ts_deriv_impl_vdw"
 33: Working Directory: /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/tests
 33: Test timeout computed to be: 1500
-20: diff: 0.587E-09, threshold: 0.100E-07: 
-24:  Frequency grid relative error: 0.12425793727288692E-009                          
-24:  Will use parallel mode: atoms     
-24: diff: 0.140E-09, threshold: 0.100E-07: 
-25:  Frequency grid relative error: 0.12425793727288692E-009                          
-25:  Will use parallel mode: atoms     
-25: diff: 0.546E-09, threshold: 0.100E-06: 
-26:  Frequency grid relative error: 0.12425793727288692E-009                          
-26:  Will use parallel mode: atoms     
-26: diff: 0.771E-09, threshold: 0.500E-07: 
+test 34
+      Start 34: grad/ts_ewald_deriv_impl_alpha
+
+34: Test command: /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/tests/mbd_grad_tests "ts_ewald_deriv_impl_alpha"
+34: Working Directory: /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/tests
+34: Test timeout computed to be: 1500
 27:  Frequency grid relative error: 0.12425793727288692E-009                          
 27:  Will use parallel mode: atoms     
 28:  Frequency grid relative error: 0.12425793727288692E-009                          
 28:  Will use parallel mode: atoms     
 28: diff: 0.103E-11, threshold: 0.100E-07: 
+23/42 Test #28: grad/ts_deriv_expl ......................   Passed    0.04 sec
+test 35
+      Start 35: grad/ts_ewald_deriv_impl_C6
+
+35: Test command: /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/tests/mbd_grad_tests "ts_ewald_deriv_impl_C6"
+35: Working Directory: /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/tests
+35: Test timeout computed to be: 1500
 29:  Frequency grid relative error: 0.12425793727288692E-009                          
 29:  Will use parallel mode: atoms     
 29: diff: 0.438E-10, threshold: 0.100E-07: 
+24/42 Test #29: grad/ts_ewald_deriv_expl ................   Passed    0.03 sec
 30:  Frequency grid relative error: 0.12425793727288692E-009                          
 30:  Will use parallel mode: atoms     
 30: diff: 0.467E-08, threshold: 0.300E-05: 
 31:  Frequency grid relative error: 0.12425793727288692E-009                          
 31:  Will use parallel mode: atoms     
 31: diff: 0.120E-11, threshold: 0.100E-06: 
+25/42 Test #31: grad/ts_deriv_impl_alpha ................   Passed    0.03 sec
 32:  Frequency grid relative error: 0.12425793727288692E-009                          
 32:  Will use parallel mode: atoms     
 32: diff: 0.169E-11, threshold: 0.500E-07: 
+26/42 Test #32: grad/ts_deriv_impl_C6 ...................   Passed    0.02 sec
 33:  Frequency grid relative error: 0.12425793727288692E-009                          
 33:  Will use parallel mode: atoms     
 33: diff: 0.544E-11, threshold: 0.100E-07: 
-22/42 Test #20: grad/mbd_rsscs_ewald_deriv_expl .........   Passed    0.19 sec
-23/42 Test #24: grad/mbd_rsscs_deriv_impl_vdw ...........   Passed    0.13 sec
-24/42 Test #25: grad/mbd_rsscs_ewald_deriv_impl_alpha ...   Passed    0.11 sec
-25/42 Test #26: grad/mbd_rsscs_ewald_deriv_impl_C6 ......   Passed    0.10 sec
-26/42 Test #28: grad/ts_deriv_expl ......................   Passed    0.07 sec
-27/42 Test #29: grad/ts_ewald_deriv_expl ................   Passed    0.05 sec
-28/42 Test #30: grad/ts_ewald_deriv_stress ..............   Passed    0.04 sec
-29/42 Test #31: grad/ts_deriv_impl_alpha ................   Passed    0.03 sec
-30/42 Test #32: grad/ts_deriv_impl_C6 ...................   Passed    0.02 sec
-31/42 Test #33: grad/ts_deriv_impl_vdw ..................   Passed    0.01 sec
-test 34
-      Start 34: grad/ts_ewald_deriv_impl_alpha
-
-34: Test command: /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/tests/mbd_grad_tests "ts_ewald_deriv_impl_alpha"
-34: Working Directory: /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/tests
-34: Test timeout computed to be: 1500
-test 35
-      Start 35: grad/ts_ewald_deriv_impl_C6
-
-35: Test command: /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/tests/mbd_grad_tests "ts_ewald_deriv_impl_C6"
-35: Working Directory: /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/tests
-35: Test timeout computed to be: 1500
+27/42 Test #33: grad/ts_deriv_impl_vdw ..................   Passed    0.02 sec
+34:  Frequency grid relative error: 0.12425793727288692E-009                          
+34:  Will use parallel mode: atoms     
+34: diff: 0.364E-10, threshold: 0.100E-06: 
 test 36
       Start 36: grad/ts_ewald_deriv_impl_vdw
 
@@ -1554,6 +1586,11 @@
 39: Test command: /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/tests/mbd_api_tests "gradients"
 39: Working Directory: /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/tests
 39: Test timeout computed to be: 1500
+35:  Frequency grid relative error: 0.12425793727288692E-009                          
+35:  Will use parallel mode: atoms     
+35: diff: 0.101E-09, threshold: 0.500E-07: 
+28/42 Test #30: grad/ts_ewald_deriv_stress ..............   Passed    0.05 sec
+29/42 Test #34: grad/ts_ewald_deriv_impl_alpha ..........   Passed    0.03 sec
 test 40
       Start 40: api/energy_from_ratios
 
@@ -1566,107 +1603,106 @@
 41: Test command: /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/tests/mbd_api_tests "hirshfeld_gradients"
 41: Working Directory: /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/tests
 41: Test timeout computed to be: 1500
-test 42
-      Start 42: api/ts_gradients
-
-42: Test command: /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/tests/mbd_api_tests "ts_gradients"
-42: Working Directory: /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/tests
-42: Test timeout computed to be: 1500
-27: diff: 0.600E-11, threshold: 0.100E-07: 
-21: diff: 0.151E-06, threshold: 0.300E-05: 
-34:  Frequency grid relative error: 0.12425793727288692E-009                          
-34:  Will use parallel mode: atoms     
-34: diff: 0.364E-10, threshold: 0.100E-06: 
-35:  Frequency grid relative error: 0.12425793727288692E-009                          
-35:  Will use parallel mode: atoms     
-35: diff: 0.101E-09, threshold: 0.500E-07: 
+30/42 Test #35: grad/ts_ewald_deriv_impl_C6 .............   Passed    0.03 sec
 36:  Frequency grid relative error: 0.12425793727288692E-009                          
 36:  Will use parallel mode: atoms     
 36: diff: 0.177E-09, threshold: 0.100E-07: 
+31/42 Test #36: grad/ts_ewald_deriv_impl_vdw ............   Passed    0.02 sec
 37:  Frequency grid relative error: 0.12425793727288692E-009                          
 37:  Will use parallel mode: none      
+32/42 Test #37: api/exception ...........................   Passed    0.02 sec
 38:  Frequency grid relative error: 0.12425793727288692E-009                          
 38:  Will use parallel mode: none      
 38:    id  level               label     count        time (s)
-38:    11      3  dipmat real                 17        0.000031
-38:    14      3  mmul                        49        0.000022
-38:    15      3  force contractions          49        0.000016
-38:    20      2  MBD dipole                   1        0.000005
-38:    21      2  MBD eig                      1        0.000034
-38:    22      2  MBD forces                   1        0.000006
-38:    30      2  SCS dipole                  16        0.000125
-38:    32      2  SCS inv                     16        0.000061
-38:    33      2  SCS forces                  16        0.000044
-38:    50      1  SCS                          1        0.000249
-38:    52      1  MBD                          1        0.000047
-38:    90      0  MBD@rsSCS                    1        0.000402
-38:    91      0  MBD@rsSCS forces             1        0.000003
+38:    11      3  dipmat real                 17        0.000049
+38:    14      3  mmul                        49        0.000038
+38:    15      3  force contractions          49        0.000027
+38:    20      2  MBD dipole                   1        0.000007
+38:    21      2  MBD eig                      1        0.000045
+38:    22      2  MBD forces                   1        0.000009
+38:    30      2  SCS dipole                  16        0.000150
+38:    32      2  SCS inv                     16        0.000093
+38:    33      2  SCS forces                  16        0.000076
+38:    50      1  SCS                          1        0.000349
+38:    52      1  MBD                          1        0.000064
+38:    90      0  MBD@rsSCS                    1        0.000526
+38:    91      0  MBD@rsSCS forces             1        0.000005
+33/42 Test #38: api/energy ..............................   Passed    0.01 sec
+test 42
+      Start 42: api/ts_gradients
+
+42: Test command: /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/tests/mbd_api_tests "ts_gradients"
+42: Working Directory: /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/tests
+42: Test timeout computed to be: 1500
 39:  Frequency grid relative error: 0.12425793727288692E-009                          
 39:  Will use parallel mode: none      
 39:    id  level               label     count        time (s)
-39:    11      3  dipmat real                 17        0.000031
-39:    14      3  mmul                        49        0.000022
-39:    15      3  force contractions          49        0.000016
-39:    20      2  MBD dipole                   1        0.000014
-39:    21      2  MBD eig                      1        0.000031
-39:    22      2  MBD forces                   1        0.000006
-39:    30      2  SCS dipole                  16        0.000041
-39:    32      2  SCS inv                     16        0.000057
-39:    33      2  SCS forces                  16        0.000044
-39:    50      1  SCS                          1        0.000160
-39:    52      1  MBD                          1        0.000053
-39:    90      0  MBD@rsSCS                    1        0.000234
-39:    91      0  MBD@rsSCS forces             1        0.000003
+39:    11      3  dipmat real                 17        0.000056
+39:    14      3  mmul                        49        0.000049
+39:    15      3  force contractions          49        0.000033
+39:    20      2  MBD dipole                   1        0.000008
+39:    21      2  MBD eig                      1        0.000047
+39:    22      2  MBD forces                   1        0.000010
+39:    30      2  SCS dipole                  16        0.000078
+39:    32      2  SCS inv                     16        0.000099
+39:    33      2  SCS forces                  16        0.000096
+39:    50      1  SCS                          1        0.000309
+39:    52      1  MBD                          1        0.000070
+39:    90      0  MBD@rsSCS                    1        0.000412
+39:    91      0  MBD@rsSCS forces             1        0.000006
 40:  Frequency grid relative error: 0.12425793727288692E-009                          
 40:  Will use parallel mode: none      
 40:    id  level               label     count        time (s)
-40:    11      3  dipmat real                 17        0.000029
-40:    14      3  mmul                        49        0.000022
-40:    15      3  force contractions          49        0.000016
-40:    20      2  MBD dipole                   1        0.000006
-40:    21      2  MBD eig                      1        0.000038
-40:    22      2  MBD forces                   1        0.000006
-40:    30      2  SCS dipole                  16        0.000040
-40:    32      2  SCS inv                     16        0.000060
-40:    33      2  SCS forces                  16        0.000044
-40:    50      1  SCS                          1        0.000162
-40:    52      1  MBD                          1        0.000054
-40:    90      0  MBD@rsSCS                    1        0.000237
-40:    91      0  MBD@rsSCS forces             1        0.000004
+40:    11      3  dipmat real                 17        0.000053
+40:    14      3  mmul                        49        0.000046
+40:    15      3  force contractions          49        0.000031
+40:    20      2  MBD dipole                   1        0.000010
+40:    21      2  MBD eig                      1        0.000051
+40:    22      2  MBD forces                   1        0.000010
+40:    30      2  SCS dipole                  16        0.000073
+40:    32      2  SCS inv                     16        0.000093
+40:    33      2  SCS forces                  16        0.000090
+40:    50      1  SCS                          1        0.000290
+40:    52      1  MBD                          1        0.000075
+40:    90      0  MBD@rsSCS                    1        0.000397
+40:    91      0  MBD@rsSCS forces             1        0.000006
 41:  Frequency grid relative error: 0.12425793727288692E-009                          
 41:  Will use parallel mode: none      
 41:    id  level               label     count        time (s)
-41:    11      3  dipmat real                 17        0.000036
-41:    14      3  mmul                        81        0.000035
-41:    15      3  force contractions          81        0.000025
-41:    20      2  MBD dipole                   1        0.000005
-41:    21      2  MBD eig                      1        0.000036
-41:    22      2  MBD forces                   1        0.000006
-41:    30      2  SCS dipole                  16        0.000051
-41:    32      2  SCS inv                     16        0.000060
-41:    33      2  SCS forces                  16        0.000072
-41:    50      1  SCS                          1        0.000202
-41:    52      1  MBD                          1        0.000049
-41:    90      0  MBD@rsSCS                    1        0.000275
-41:    91      0  MBD@rsSCS forces             1        0.000012
+41:    11      3  dipmat real                 17        0.000054
+41:    14      3  mmul                        81        0.000061
+41:    15      3  force contractions          81        0.000069
+41:    20      2  MBD dipole                   1        0.000009
+41:    21      2  MBD eig                      1        0.000045
+41:    22      2  MBD forces                   1        0.000009
+41:    30      2  SCS dipole                  16        0.000096
+41:    32      2  SCS inv                     16        0.000087
+41:    33      2  SCS forces                  16        0.000151
+41:    50      1  SCS                          1        0.000362
+41:    52      1  MBD                          1        0.000065
+41:    90      0  MBD@rsSCS                    1        0.000455
+41:    91      0  MBD@rsSCS forces             1        0.000018
+34/42 Test #39: api/gradients ...........................   Passed    0.02 sec
+35/42 Test #40: api/energy_from_ratios ..................   Passed    0.02 sec
+36/42 Test #41: api/hirshfeld_gradients .................   Passed    0.02 sec
+25: diff: 0.546E-09, threshold: 0.100E-06: 
+37/42 Test #25: grad/mbd_rsscs_ewald_deriv_impl_alpha ...   Passed    0.09 sec
+26: diff: 0.771E-09, threshold: 0.500E-07: 
+38/42 Test #26: grad/mbd_rsscs_ewald_deriv_impl_C6 ......   Passed    0.09 sec
 42:  Frequency grid relative error: 0.12425793727288692E-009                          
 42:  Will use parallel mode: none      
 42:    id  level               label     count        time (s)
-32/42 Test #21: grad/mbd_rsscs_ewald_deriv_stress .......   Passed    0.30 sec
-33/42 Test #27: grad/mbd_rsscs_ewald_deriv_impl_vdw .....   Passed    0.21 sec
-34/42 Test #34: grad/ts_ewald_deriv_impl_alpha ..........   Passed    0.12 sec
-35/42 Test #35: grad/ts_ewald_deriv_impl_C6 .............   Passed    0.12 sec
-36/42 Test #36: grad/ts_ewald_deriv_impl_vdw ............   Passed    0.11 sec
-37/42 Test #37: api/exception ...........................   Passed    0.10 sec
-38/42 Test #38: api/energy ..............................   Passed    0.08 sec
-39/42 Test #39: api/gradients ...........................   Passed    0.07 sec
-40/42 Test #40: api/energy_from_ratios ..................   Passed    0.05 sec
-41/42 Test #41: api/hirshfeld_gradients .................   Passed    0.03 sec
-42/42 Test #42: api/ts_gradients ........................   Passed    0.01 sec
+39/42 Test #42: api/ts_gradients ........................   Passed    0.01 sec
+27: diff: 0.600E-11, threshold: 0.100E-07: 
+40/42 Test #27: grad/mbd_rsscs_ewald_deriv_impl_vdw .....   Passed    0.09 sec
+20: diff: 0.587E-09, threshold: 0.100E-07: 
+41/42 Test #20: grad/mbd_rsscs_ewald_deriv_expl .........   Passed    0.15 sec
+21: diff: 0.151E-06, threshold: 0.300E-05: 
+42/42 Test #21: grad/mbd_rsscs_ewald_deriv_stress .......   Passed    0.23 sec
 
 100% tests passed, 0 tests failed out of 42
 
-Total Test time (real) =   0.51 sec
+Total Test time (real) =   0.31 sec
 make[1]: Leaving directory '/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu'
    create-stamp debian/debhelper-build-stamp
    dh_testroot -O--buildsystem=cmake
@@ -1688,23 +1724,23 @@
 make[3]: Leaving directory '/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu'
 [ 82%] Built target mbd
 make  -f tests/CMakeFiles/mbd_grad_tests.dir/build.make tests/CMakeFiles/mbd_grad_tests.dir/depend
+make  -f tests/CMakeFiles/mbd_api_tests.dir/build.make tests/CMakeFiles/mbd_api_tests.dir/depend
 make[3]: Entering directory '/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu'
 cd /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libmbd-0.12.8 /build/reproducible-path/libmbd-0.12.8/tests /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/tests /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/tests/CMakeFiles/mbd_grad_tests.dir/DependInfo.cmake "--color="
-make  -f tests/CMakeFiles/mbd_api_tests.dir/build.make tests/CMakeFiles/mbd_api_tests.dir/depend
 make[3]: Entering directory '/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu'
 cd /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libmbd-0.12.8 /build/reproducible-path/libmbd-0.12.8/tests /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/tests /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/tests/CMakeFiles/mbd_api_tests.dir/DependInfo.cmake "--color="
 make[3]: Leaving directory '/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu'
+make  -f tests/CMakeFiles/mbd_api_tests.dir/build.make tests/CMakeFiles/mbd_api_tests.dir/build
+make[3]: Leaving directory '/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu'
 make  -f tests/CMakeFiles/mbd_grad_tests.dir/build.make tests/CMakeFiles/mbd_grad_tests.dir/build
 make[3]: Entering directory '/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu'
-make[3]: Nothing to be done for 'tests/CMakeFiles/mbd_grad_tests.dir/build'.
-make[3]: Leaving directory '/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu'
+make[3]: Nothing to be done for 'tests/CMakeFiles/mbd_api_tests.dir/build'.
 make[3]: Leaving directory '/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu'
-make  -f tests/CMakeFiles/mbd_api_tests.dir/build.make tests/CMakeFiles/mbd_api_tests.dir/build
 make[3]: Entering directory '/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu'
-make[3]: Nothing to be done for 'tests/CMakeFiles/mbd_api_tests.dir/build'.
+make[3]: Nothing to be done for 'tests/CMakeFiles/mbd_grad_tests.dir/build'.
 make[3]: Leaving directory '/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu'
-[ 89%] Built target mbd_api_tests
-[100%] Built target mbd_grad_tests
+[ 92%] Built target mbd_grad_tests
+[100%] Built target mbd_api_tests
 make[2]: Leaving directory '/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu'
 /usr/bin/cmake -E cmake_progress_start /build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu/CMakeFiles 0
 make  -f CMakeFiles/Makefile2 preinstall
@@ -1721,24 +1757,24 @@
 -- Installing: /build/reproducible-path/libmbd-0.12.8/debian/libmbd-dev/usr/include/mbd/mbd.mod
 -- Installing: /build/reproducible-path/libmbd-0.12.8/debian/libmbd-dev/usr/include/mbd/mbd_methods.mod
 -- Installing: /build/reproducible-path/libmbd-0.12.8/debian/libmbd-dev/usr/include/mbd/mbd_coulomb.mod
--- Installing: /build/reproducible-path/libmbd-0.12.8/debian/libmbd-dev/usr/include/mbd/mbd_scs.mod
 -- Installing: /build/reproducible-path/libmbd-0.12.8/debian/libmbd-dev/usr/include/mbd/mbd_rpa.mod
 -- Installing: /build/reproducible-path/libmbd-0.12.8/debian/libmbd-dev/usr/include/mbd/mbd_hamiltonian.mod
+-- Installing: /build/reproducible-path/libmbd-0.12.8/debian/libmbd-dev/usr/include/mbd/mbd_scs.mod
 -- Installing: /build/reproducible-path/libmbd-0.12.8/debian/libmbd-dev/usr/include/mbd/mbd_dipole.mod
--- Installing: /build/reproducible-path/libmbd-0.12.8/debian/libmbd-dev/usr/include/mbd/mbd_density.mod
 -- Installing: /build/reproducible-path/libmbd-0.12.8/debian/libmbd-dev/usr/include/mbd/mbd_ts.mod
+-- Installing: /build/reproducible-path/libmbd-0.12.8/debian/libmbd-dev/usr/include/mbd/mbd_density.mod
 -- Installing: /build/reproducible-path/libmbd-0.12.8/debian/libmbd-dev/usr/include/mbd/mbd_matrix.mod
 -- Installing: /build/reproducible-path/libmbd-0.12.8/debian/libmbd-dev/usr/include/mbd/mbd_geom.mod
--- Installing: /build/reproducible-path/libmbd-0.12.8/debian/libmbd-dev/usr/include/mbd/mbd_lapack.mod
 -- Installing: /build/reproducible-path/libmbd-0.12.8/debian/libmbd-dev/usr/include/mbd/mbd_vdw_param.mod
+-- Installing: /build/reproducible-path/libmbd-0.12.8/debian/libmbd-dev/usr/include/mbd/mbd_lapack.mod
 -- Installing: /build/reproducible-path/libmbd-0.12.8/debian/libmbd-dev/usr/include/mbd/mbd_formulas.mod
 -- Installing: /build/reproducible-path/libmbd-0.12.8/debian/libmbd-dev/usr/include/mbd/mbd_damping.mod
 -- Installing: /build/reproducible-path/libmbd-0.12.8/debian/libmbd-dev/usr/include/mbd/mbd_utils.mod
 -- Installing: /build/reproducible-path/libmbd-0.12.8/debian/libmbd-dev/usr/include/mbd/mbd_linalg.mod
--- Installing: /build/reproducible-path/libmbd-0.12.8/debian/libmbd-dev/usr/include/mbd/mbd_gradients.mod
 -- Installing: /build/reproducible-path/libmbd-0.12.8/debian/libmbd-dev/usr/include/mbd/mbd_defaults.mod
--- Installing: /build/reproducible-path/libmbd-0.12.8/debian/libmbd-dev/usr/include/mbd/mbd_version.mod
+-- Installing: /build/reproducible-path/libmbd-0.12.8/debian/libmbd-dev/usr/include/mbd/mbd_gradients.mod
 -- Installing: /build/reproducible-path/libmbd-0.12.8/debian/libmbd-dev/usr/include/mbd/mbd_constants.mod
+-- Installing: /build/reproducible-path/libmbd-0.12.8/debian/libmbd-dev/usr/include/mbd/mbd_version.mod
 -- Installing: /build/reproducible-path/libmbd-0.12.8/debian/libmbd-dev/usr/lib/aarch64-linux-gnu/cmake/mbd/MbdConfig.cmake
 -- Installing: /build/reproducible-path/libmbd-0.12.8/debian/libmbd-dev/usr/lib/aarch64-linux-gnu/cmake/mbd/MbdConfig-release.cmake
 make[1]: Leaving directory '/build/reproducible-path/libmbd-0.12.8/obj-aarch64-linux-gnu'
@@ -1767,12 +1803,14 @@
 dpkg-buildpackage: info: binary-only upload (no source included)
 dpkg-genchanges: info: including full source code in upload
 I: copying local configuration
+I: user script /srv/workspace/pbuilder/2613561/tmp/hooks/B01_cleanup starting
+I: user script /srv/workspace/pbuilder/2613561/tmp/hooks/B01_cleanup finished
 I: unmounting dev/ptmx filesystem
 I: unmounting dev/pts filesystem
 I: unmounting dev/shm filesystem
 I: unmounting proc filesystem
 I: unmounting sys filesystem
 I: cleaning the build env 
-I: removing directory /srv/workspace/pbuilder/2896936 and its subdirectories
-I: Current time: Sat Mar 15 07:05:54 -12 2025
-I: pbuilder-time-stamp: 1742065554
+I: removing directory /srv/workspace/pbuilder/2613561 and its subdirectories
+I: Current time: Sat Apr 18 15:30:21 +14 2026
+I: pbuilder-time-stamp: 1776475821