368 Commits

Author SHA1 Message Date
b2b8380401 ADD: relion@5.0.0 GPU sles15/aarch64/unstable 2025-01-27 09:14:00 +01:00
89cb0ee34f FIX: wrong openmpi spec (aarch64 sles) 2025-01-09 14:10:09 +01:00
c7a80262eb ADD: compiler as external package (x86_64) 2025-01-08 08:49:09 +01:00
f903a3188a ADD: relion PSI package 2025-01-08 08:45:19 +01:00
d5569a0d9f ADD: compilers to unstable SLES aarch64 2024-12-13 11:44:10 +01:00
170fc78d4d FIX: add aarch64 compilers as packages and remove them from compilers.yaml 2024-12-13 10:11:31 +01:00
f8f98c6db9 FIX: remove wrong relion spec GH aarch64 2024-12-11 13:21:16 +01:00
fef3198253 ADD: relion@4.0.1 GH 2024-12-09 13:49:30 +01:00
6c7b80c0de ADD: OMPI_MCA_mtl_ofi_disable_hmem: 'true' to openmpi module creation 2024-12-06 15:48:19 +01:00
6bd4af4b36 FIX: remove +pmi for openmpi > 5.0.0 2024-12-06 15:27:39 +01:00
dd8b8f150c ADD: cp2k aarch64 GH 2024-12-06 15:27:38 +01:00
bae6939841 ADD: opal-x GH200 2024-12-06 15:27:38 +01:00
d033681018 ADD: aarch64 to be available for users and admin on login nodes 2024-11-13 16:25:58 +01:00
030373be10 ADD: gromacs and ffbidx 2024-11-12 18:17:53 +01:00
b0c927f440 ADD: gcc@=13.2.0 sles15, aarch64 2024-11-11 16:22:52 +01:00
8a455a7727 ADD: opal-x build back for A100 2024-11-11 15:32:30 +01:00
8354132792 ADD: hdf5%intel +mpi (openmpi) sles unstable 2024-11-07 15:58:33 +01:00
114945acd4 ADD: sles unstable: hdf5-parallel ^openmpi 2024-11-07 14:34:03 +01:00
bc38ceb9c9 FIX: spelling (cxx_exceptions) 2024-11-07 10:53:06 +01:00
65e12fc811 FIX: remove preference for cray-mpich and use pmix 2024-11-07 10:45:22 +01:00
9553585216 FIX: put default mpi type pmix for sles mpi modules 2024-11-07 09:28:55 +01:00
167ff7e556 ADD: personalised spack repos 2024-11-05 15:32:54 +01:00
52d3517016 ADD: pmi-interface=pmi2 for openmpi merlin6/ra 2024-11-05 10:51:56 +01:00
d19f9846aa FIX: add rhel8 concretization to rhel7 and vice versa 2024-11-05 10:41:13 +01:00
d5fe042967 Update file README.md 2024-11-04 15:33:25 +01:00
22a9a652b4 FIX: remaining rhel7 variables for rhel8 env 2024-11-04 15:22:52 +01:00
33f1d144dc FIX: modules entry missing in compilers.yaml (SLES) 2024-11-04 13:58:33 +01:00
d64194ccb3 ADD: rhel8 envs 2024-10-29 17:13:51 +01:00
dff7377a21 ADD: sundials@7.0.0 merlin7 x86 2024-10-25 11:18:39 +02:00
b74fb5f077 ADD: openmpi@4.1.6%intel 2024-10-23 16:11:28 +02:00
23ae642e73 ADD: gcc@13.2.0 2024-10-23 12:52:29 +02:00
ec617d06df FIX: oneapi compiler installation and compiler 2024-10-18 15:11:26 +02:00
284cf47b9e ADD: compilers to SLES stable 2024-10-18 10:47:13 +02:00
9467ba2908 ADD: mfem package 2024-10-18 10:46:00 +02:00
64414d31fa ADD: mfem missing package 2024-10-18 10:12:01 +02:00
e2affe8818 Merge branch 'refactoring_16.10.2024' into 'main'
FIX: move spack-psi bye one folder

See merge request lsm-hpce/spack-psi!8
2024-10-17 15:33:40 +02:00
16f4f1a137 FIX: move spack-psi bye one folder 2024-10-17 15:33:40 +02:00
27a597eda1 ADD: openmpi%intel@2021.6.0 unstable SLELS x86_64 2024-10-10 16:53:54 +02:00
3809cd7a5c ADD: correct default openmpi variants for all compilers 2024-10-10 16:52:03 +02:00
9204ad79cf FIX: require autoconf and automake to use system compiler 2024-10-10 16:52:02 +02:00
c9d4198917 ADD: intel@2021.6 compiler 2024-10-10 16:52:02 +02:00
c2d1003eb4 FIX: IPPL package 2024-10-09 16:11:29 +02:00
97d81f5fba ADD: unit_tests variant opal-x 2024-10-09 14:50:04 +02:00
39f2942b80 ADD: fixSolverUnits branch 2024-10-09 14:49:37 +02:00
99be3bda8a ADD: h5hut 2.0.0rc7 correct hashsum 2024-10-09 14:49:21 +02:00
0c86e178d3 ADD: h5hut@2.0.0rc7 2024-10-08 13:44:59 +02:00
2569625d30 FIX: h5hut@master + opal-x CUDA problem 2024-10-08 09:59:48 +02:00
eef26d712c FIX: opal-x build 2024-10-04 09:54:42 +02:00
51daa45753 ADD: first opal-x package draft 2024-09-30 17:42:41 +02:00
7bdbfd4ceb FIX: new packages.yaml for new nvhpc 2024-09-26 16:29:26 +02:00