comp-chem/cp2k
1
0
Fork 0
mirror of https://github.com/cp2k/cp2k.git synced 2026-07-21 14:35:15 -04:00
Code Issues Projects Releases Packages Wiki Activity Actions

Docker: Disable SIRIUS for psmp to workaround COSMA performance issue

Browse source
This commit is contained in:
Ole Schütt 2026-01-04 21:04:37 +01:00 • committed by Ole Schütt
parent ec136938e7
commit 71983cdebc
1 changed files with 3 additions and 0 deletions
Download patch file Download diff file Expand all files Collapse all files

3
cmake/cmake_cp2k.sh
View file

@ -91,12 +91,15 @@ elif [[ "${PROFILE}" == "toolchain" ]] && [[ "${VERSION}" == "sdbg" ]]; then
CMAKE_EXIT_CODE=$?
elif [[ "${PROFILE}" == "toolchain" ]] && [[ "${VERSION}" == "psmp" ]]; then
# TODO Re-enable SIRIUS once performance regression of COSMA is fixed:
# https://github.com/cp2k/cp2k/issues/4663
cmake \
-GNinja \
-DCMAKE_INSTALL_PREFIX="${INSTALL_PREFIX}" \
-DCP2K_USE_EVERYTHING=ON \
-DCP2K_USE_DLAF=OFF \
-DCP2K_USE_PEXSI=OFF \
-DCP2K_USE_SIRIUS=OFF \
-Werror=dev \
.. |& tee ./cmake.log
CMAKE_EXIT_CODE=$?