svcusr-spack (Resp. Germann Elsa Sylvia)
|
177feba2d4
|
ADD: env testing must be clean before new installation
|
2025-03-12 08:45:51 +01:00 |
|
svcusr-spack (Resp. Germann Elsa Sylvia)
|
1fe2050e04
|
ADD: unstable lock file
|
2025-03-12 08:44:31 +01:00 |
|
svcusr-spack (Resp. Germann Elsa Sylvia)
|
16d320e06e
|
ADD: new openmpi compilers
|
2025-03-12 08:44:03 +01:00 |
|
svcusr-spack (Resp. Germann Elsa Sylvia)
|
dc216a4094
|
ADD: osu-micro-benchmarks + py-torch SLES15 unstable
|
2025-02-28 10:19:28 +01:00 |
|
svcusr-spack (Resp. Germann Elsa Sylvia)
|
2c628dc755
|
ADD: dssp & relion ^cray-mpich aarch64 unstable
|
2025-02-21 09:22:04 +01:00 |
|
svcusr-spack (Resp. Germann Elsa Sylvia)
|
154f68edc3
|
ADD: LD_LIBRARY_PATH: /opt/cray/libfabric/1.15.2.0/lib64 to cray-mpich modules
|
2025-02-21 09:19:30 +01:00 |
|
svcusr-spack (Resp. Germann Elsa Sylvia)
|
243615407e
|
ADD: dmtcp x86_64 unstable SLES
|
2025-02-20 08:49:43 +01:00 |
|
svcusr-spack (Resp. Germann Elsa Sylvia)
|
a0bcbb5c1d
|
FIX: put nvhpc@24.11 aarch64 in unstable env
|
2025-02-05 16:07:26 +01:00 |
|
svcusr-spack (Resp. Germann Elsa Sylvia)
|
f3f6d88d09
|
ADD: q-e@7.4 +mpi+mpigpu+cuda hdf5=paralla GH200
|
2025-02-05 16:03:32 +01:00 |
|
svcusr-spack (Resp. Germann Elsa Sylvia)
|
853fa71cb1
|
ADD: +munge requirement for pmix
|
2025-02-03 16:35:03 +01:00 |
|
svcusr-spack (Resp. Germann Elsa Sylvia)
|
723128554d
|
FIX: providers for quantum-espresso
|
2025-02-03 16:32:41 +01:00 |
|
svcusr-spack (Resp. Germann Elsa Sylvia)
|
65f678efe7
|
FIX: remove wrong q-e package on spack-psi
|
2025-02-03 16:31:46 +01:00 |
|
svcusr-spack (Resp. Germann Elsa Sylvia)
|
8068f5cfba
|
ADD: nvhpc@24.11 compiler spack/develop sles/aarch64
|
2025-02-03 16:31:04 +01:00 |
|
svcusr-spack (Resp. Germann Elsa Sylvia)
|
7df462761b
|
FIX: nvhpc module for aarch64 sles15
|
2025-01-27 14:36:21 +01:00 |
|
svcusr-spack (Resp. Germann Elsa Sylvia)
|
c199d3f74b
|
FIX: mpi always taking cray-mpich problem
|
2025-01-27 14:35:13 +01:00 |
|
svcusr-spack (Resp. Germann Elsa Sylvia)
|
b453b0739d
|
FIX: nvhpc@23.9 modules
|
2025-01-27 09:54:48 +01:00 |
|
svcusr-spack (Resp. Germann Elsa Sylvia)
|
aa9386d3ff
|
FIX: remove cray-hdf5
|
2025-01-27 09:54:25 +01:00 |
|
svcusr-spack (Resp. Germann Elsa Sylvia)
|
aa08c30d0b
|
ADD: gcc%9.5.0 compiler sles15/x86_64
|
2025-01-27 09:53:49 +01:00 |
|
svcusr-spack (Resp. Germann Elsa Sylvia)
|
9687040f67
|
ADD: q-e-sirius%gcc@9.5.0 sles15/x86_64/unstable
|
2025-01-27 09:53:18 +01:00 |
|
svcusr-spack (Resp. Germann Elsa Sylvia)
|
75de5a0bf0
|
ADD: compilers spec to sles15/x86_64/stable
|
2025-01-27 09:49:40 +01:00 |
|
svcusr-spack (Resp. Germann Elsa Sylvia)
|
329228992a
|
ADD: compilers spec to sles15/x86_64/stable
|
2025-01-27 09:49:21 +01:00 |
|
svcusr-spack (Resp. Germann Elsa Sylvia)
|
6176517a33
|
FIX: remove gtkplus as external
|
2025-01-27 09:16:09 +01:00 |
|
svcusr-spack (Resp. Germann Elsa Sylvia)
|
b2b8380401
|
ADD: relion@5.0.0 GPU sles15/aarch64/unstable
|
2025-01-27 09:14:00 +01:00 |
|
svcusr-spack (Resp. Germann Elsa Sylvia)
|
89cb0ee34f
|
FIX: wrong openmpi spec (aarch64 sles)
|
2025-01-09 14:10:09 +01:00 |
|
svcusr-spack (Resp. Germann Elsa Sylvia)
|
c7a80262eb
|
ADD: compiler as external package (x86_64)
|
2025-01-08 08:49:09 +01:00 |
|
svcusr-spack (Resp. Germann Elsa Sylvia)
|
f903a3188a
|
ADD: relion PSI package
|
2025-01-08 08:45:19 +01:00 |
|
svcusr-spack (Resp. Germann Elsa Sylvia)
|
d5569a0d9f
|
ADD: compilers to unstable SLES aarch64
|
2024-12-13 11:44:10 +01:00 |
|
svcusr-spack (Resp. Germann Elsa Sylvia)
|
170fc78d4d
|
FIX: add aarch64 compilers as packages and remove them from compilers.yaml
|
2024-12-13 10:11:31 +01:00 |
|
svcusr-spack (Resp. Germann Elsa Sylvia)
|
f8f98c6db9
|
FIX: remove wrong relion spec GH aarch64
|
2024-12-11 13:21:16 +01:00 |
|
svcusr-spack (Resp. Germann Elsa Sylvia)
|
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 |
|
svcusr-spack (Resp. Germann Elsa Sylvia)
|
6bd4af4b36
|
FIX: remove +pmi for openmpi > 5.0.0
|
2024-12-06 15:27:39 +01:00 |
|
svcusr-spack (Resp. Germann Elsa Sylvia)
|
dd8b8f150c
|
ADD: cp2k aarch64 GH
|
2024-12-06 15:27:38 +01:00 |
|
svcusr-spack (Resp. Germann Elsa Sylvia)
|
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 |
|
svcusr-spack (Resp. Germann Elsa Sylvia)
|
030373be10
|
ADD: gromacs and ffbidx
|
2024-11-12 18:17:53 +01:00 |
|
svcusr-spack (Resp. Germann Elsa Sylvia)
|
b0c927f440
|
ADD: gcc@=13.2.0 sles15, aarch64
|
2024-11-11 16:22:52 +01:00 |
|
svcusr-spack (Resp. Germann Elsa Sylvia)
|
8a455a7727
|
ADD: opal-x build back for A100
|
2024-11-11 15:32:30 +01:00 |
|
svcusr-spack (Resp. Germann Elsa Sylvia)
|
8354132792
|
ADD: hdf5%intel +mpi (openmpi) sles unstable
|
2024-11-07 15:58:33 +01:00 |
|
svcusr-spack (Resp. Germann Elsa Sylvia)
|
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 |
|
svcusr-spack (Resp. Germann Elsa Sylvia)
|
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 |
|
svcusr-spack (Resp. Germann Elsa Sylvia)
|
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 |
|
