SY Wang
701d1e8c46
[CMake] Make CP2K_USE_OPENPMD part of CP2K_USE_EVERYTHING
2026-07-01 16:37:23 +02:00
SY Wang
1e0ab71985
Docker: Improve Spack image build caching ( #5462 )
2026-06-25 16:28:47 +02:00
Matthias Krack
4738a5a401
Switch opensuse tester to GCC 13 ( #5368 )
2026-06-07 08:26:01 +02:00
Matthias Krack
0eb17dafdc
Update spack tester for OpenSUSE: 15.6 -> 16.0 ( #5252 )
2026-05-19 21:38:18 +02:00
SY Wang
ea7c263a32
Spack docker tester: Restore cache setup and access via host endpoint ( #5236 )
2026-05-18 16:41:25 +02:00
SY Wang
8ba4bd1763
Spack docker tester: Use a dedicated cache network instead of host ( #5218 )
2026-05-17 17:14:54 +02:00
Matthias Krack
59927b9229
make_cp2k.sh: Introduce --use_cache flag ( #5149 )
2026-05-08 09:59:03 +02:00
Matthias Krack
6f80f8717e
Prepend ERROR to failure message ( #5113 )
2026-04-28 21:34:07 +02:00
Matthias Krack
02a6ce975b
Finalise image even if tests failed ( #5110 )
2026-04-28 11:48:05 +02:00
Matthias Krack
35dc0ecb7d
Add image tag name flag to usage example in the dockerfile headers
...
That image tag name is picked up by make_cp2k.sh as IMAGE_TAG
2026-04-25 09:43:56 +02:00
Matthias Krack
8f971e11a4
Run spack regression tests with keepalive
2026-04-16 12:14:17 +02:00
Matthias Krack
993cc6f902
Split container builds in 3 stages to imorove caching
2026-02-21 00:36:37 +01:00
Matthias Krack
fe07ba5a00
Replace the unreliable ldd by ldconfig
...
to detect all library paths needed by the CP2K binary
- Pin ninja version after removing the package from the base image installation
- Update Rocky Linux version from 9.3 to 10 (latest)
- Remove CMake cleaning step, because it causes that CP2K is always recompiled from scratch which is a feature already covered by the --rebuild_cp2k flag on user request
- Move back from lscpu to nproc, because lscpu provides always a host view also within containers whereas nproc shows the container-visible CPUs (cgroup limits)
2026-02-20 20:56:44 +01:00
Matthias Krack
eaadeeb9d3
Enable OpenPMD explicitly (not done by default)
2026-02-16 17:02:23 +01:00
Matthias Krack
0c3f48da69
Add spack based psmp CUDA P100 tester
2026-02-15 14:05:49 +01:00
Matthias Krack
3c434384a8
Drop version from spack folder name
2026-02-12 13:37:02 +01:00
Matthias Krack
e0d5c8ef3d
Add spack based ssmp CUDA P100 tester
2026-02-11 15:19:56 +01:00
Matthias Krack
9767e520d0
Simplify: merge entrypoint and launch script
2026-02-09 17:53:43 +01:00
Matthias Krack
8de6fc2277
Mute zypper command
2026-02-09 17:53:43 +01:00
Matthias Krack
55d334afdb
Add spack psmp tester for openSUSE (leap 15.6)
2026-02-09 17:53:43 +01:00