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Update nightly test configurations #5243

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merged 2 commits into from
Nov 27, 2024
Merged

Update nightly test configurations #5243

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019f23a
Update test configs
prckent Nov 26, 2024
d120860
Merge branch 'develop' into testcfg
ye-luo Nov 27, 2024
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35 changes: 15 additions & 20 deletions tests/test_automation/nightly_test_scripts/ornl_setup.sh
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Original file line number Diff line number Diff line change
Expand Up @@ -79,11 +79,6 @@ packages:
- spec: openssl@1.1.1k
prefix: /usr
buildable: False
libffi:
externals:
- spec: libffi@3.4.2
prefix: /
buildable: False
EOF
;;
nitrogen )
Expand All @@ -110,11 +105,6 @@ packages:
- spec: openssl@1.1.1k
prefix: /usr
buildable: False
libffi:
externals:
- spec: libffi@3.4.2
prefix: /
buildable: False
EOF
;;
sulfur )
Expand All @@ -141,11 +131,6 @@ packages:
- spec: openssl@1.1.1k
prefix: /usr
buildable: False
libffi:
externals:
- spec: libffi@3.4.2
prefix: /
buildable: False
EOF
;;
*)
Expand Down Expand Up @@ -197,12 +182,22 @@ cd $HOME/apps/spack

# For reproducibility, use a specific version of Spack
# Prefer to use tagged releases https://github.com/spack/spack/releases
git checkout eb9ff5d7a7d47f112ece5a4c70ef603a047a2fbc
#commit eb9ff5d7a7d47f112ece5a4c70ef603a047a2fbc (HEAD -> develop, origin/develop, origin/HEAD)
#Author: Harmen Stoppels <me@harmenstoppels.nl>
#Date: Tue Nov 5 13:25:19 2024 +0100

git checkout 75b03bc12ffbabdfac0775ead5442c3f102f94c7
#commit 75b03bc12ffbabdfac0775ead5442c3f102f94c7 (HEAD -> develop, origin/develop, origin/HEAD)
#Author: Adam J. Stewart <ajstewart426@gmail.com>
#Date: Sun Nov 24 20:55:18 2024 +0100
#
# glib: add v2.82.2 (#47766)

#git checkout dfab174f3100840c889e8bb939260b64d93d8dbd
#commit dfab174f3100840c889e8bb939260b64d93d8dbd (HEAD -> develop, origin/develop, origin/HEAD)
#Author: Stephen Nicholas Swatman <stephen@v25.nl>
#Date: Mon Nov 18 14:04:52 2024 +0100
#
# paraview: add forward compat bound with cuda (#47430)
# benchmark: add version 1.9.0 (#47658)
#
# This commit adds Google Benchmark v1.9.0.

echo --- Git version and last log entry
git log -1
Expand Down
10 changes: 8 additions & 2 deletions tests/test_automation/nightly_test_scripts/ornl_setup_environments.sh
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Expand Up @@ -103,13 +103,16 @@ spack add py-numpy@${numpy_vnew}
spack add py-scipy
spack add py-h5py ^hdf5@${hdf5_vnew}%gcc@${gcc_vnew} +fortran +hl +mpi
spack add quantum-espresso@7.4 +mpi +qmcpack
export CMAKE_BUILD_PARALLEL_LEVEL=8 # For PySCF
spack add py-pyscf
#spack add rmgdft #Fails to compile with GCC14 due to bug in vendored SCALAPACK

#Luxury options for actual science use:
spack add py-requests # for pseudo helper
spack add py-ase # full Atomic Simulation Environment
#spack add graphviz +ghostscript +libgd +pangocairo +poppler # NEXUS requires optional PNG support
#spack add graphviz +libgd # NEXUS requires optional PNG support in dot
spack add libffi
spack add graphviz +pangocairo # NEXUS requires optional PNG support in dot
spack add py-pydot # NEXUS optional
spack add py-spglib # NEXUS optional
spack add py-seekpath # NEXUS optional
Expand Down Expand Up @@ -211,13 +214,16 @@ spack add py-numpy@${numpy_vold}
spack add py-scipy
spack add py-h5py ^hdf5@${hdf5_vnew}%gcc@${gcc_vold} +fortran +hl +mpi
#spack add quantum-espresso@7.4 +mpi +qmcpack
#export CMAKE_BUILD_PARALLEL_LEVEL=8 # For PySCF
#spack add py-pyscf
spack add rmgdft

#Luxury options for actual science use:
spack add py-requests # for pseudo helper
spack add py-ase # full Atomic Simulation Environment
#spack add graphviz +ghostscript +libgd +pangocairo +poppler # NEXUS requires optional PNG support
#spack add graphviz +libgd # NEXUS requires optional PNG support in dot
spack add libffi
spack add graphviz +pangocairo # NEXUS requires optional PNG support in dot
spack add py-pydot # NEXUS optional
spack add py-spglib # NEXUS optional
spack add py-seekpath # NEXUS optional
Expand Down
2 changes: 1 addition & 1 deletion tests/test_automation/nightly_test_scripts/ornl_versions.sh
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Expand Up @@ -18,7 +18,7 @@ gcc_vllvmoffload=${gcc_vold}

# LLVM
# Dates at https://releases.llvm.org/
llvm_vnew=19.1.3 # Released 2024-10-30
llvm_vnew=19.1.4 # Released 2024-11-19
llvm_voffload=${llvm_vnew}
cuda_voffload=12.4.0 # CUDA version for offload builds

Expand Down
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