31 Commits

Author SHA1 Message Date
49656625f1 FIX: forgotten libfabric@1.15.2.0 2025-03-13 08:58:13 +01:00
65f678efe7 FIX: remove wrong q-e package on spack-psi 2025-02-03 16:31:46 +01:00
f903a3188a ADD: relion PSI package 2025-01-08 08:45:19 +01:00
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
16f4f1a137 FIX: move spack-psi bye one folder 2024-10-17 15:33:40 +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
6415b02ed0 FIX: cuda package failure 2024-07-30 15:41:35 +02:00
8f1b6c5754 ADD: quantum-espresso PSI 2024-07-25 09:07:18 +02:00
a3cd601e79 ADD: cuda PSI package 2024-07-25 09:01:53 +02:00
61ad0d8fc4 FIX: opal@2024.1.0%gcc@12.3 build 2024-07-19 18:10:18 +02:00
d2e2bc841d FIX: opal can run with python@3.0: 2024-07-09 16:53:31 +02:00
57dd2a751a FIX: slurm package to take cray_shasta option 2024-07-08 14:27:56 +02:00
993b5a428b FIX: Sratoolkit -> SpackSratoolkit 2024-07-04 16:03:11 +02:00
b2f4f40bd4 FIX: add sratoolkit@3.1.1 2024-07-04 14:46:28 +02:00
f9c2a4afc8 ADD: Slurm 24.05.1 + 23.11.8 versions 2024-07-04 11:04:29 +02:00
068efd0c6b ADD: extra version pkgs needed by alphafold 2024-05-31 12:42:24 +02:00
729882fb65 ADD: alphafold newest versions 2024-05-28 10:38:00 +02:00
dd6456d142 FIX: spack.pkg.builtin.cray_libsci 2024-05-23 15:24:38 +02:00
628cf312d2 ADD: cray-libsci fix 2024-05-23 09:01:13 +02:00
122d03222d FIX: remove harcoded hdf5 and boost version 2024-05-23 08:47:32 +02:00
a50e9c6253 FIX: remove openmpi and openblas hardcoded dependency 2024-05-17 14:44:01 +02:00
1295f4db59 ADD: first commit 2024-05-16 11:01:56 +02:00
adb8e3eb09 Spack Prototype for PSI 2023-04-27 08:06:59 +00:00