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add_cmatrix

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refactoring_16.10.2024

rhel7

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• 0320048c57 FIX: requirements for nvhpc compilers svcusr-spack (Resp. Germann Elsa Sylvia) 2024-06-19 16:40:02 +02:00
• 2d0c6ca324 ADD: intel-oneapi-compilers svcusr-spack (Resp. Germann Elsa Sylvia) 2024-06-19 16:39:45 +02:00
• 683b14c391 FIX: openmpi%nvhpc can't use variant +cxx_exceptions germann_e 2024-06-19 13:30:15 +02:00
• babaf986b2 FIX: add cuda version must be 12.2: to work on Gwendolen as well germann_e 2024-06-19 13:29:38 +02:00
• b5c2c4e292 ADD: oneapi@2024.1.0 compiler germann_e 2024-06-19 13:29:11 +02:00
• 9f727a9866 Merge branch 'main' of https://gitlab.psi.ch/lsm-hpce/spack-psi into main svcusr-spack (Resp. Germann Elsa Sylvia) 2024-06-19 10:39:21 +02:00
• 65c2cb9943 FIX: update rhel7 unstable spack.lock svcusr-spack (Resp. Germann Elsa Sylvia) 2024-06-19 10:38:09 +02:00
• 9c4a6588a7 ADD: py-alphafold@2.3.2 +cuda rhel7 unstable svcusr-spack (Resp. Germann Elsa Sylvia) 2024-06-19 10:37:27 +02:00
• e81aa26256 FIX: hardcode rhel7 to use it on Gwendolen as well germann_e 2024-06-19 09:48:18 +02:00
• a3ee399a3f FIX: use definitions for unstable env (rhel7) svcusr-spack (Resp. Germann Elsa Sylvia) 2024-06-19 09:36:22 +02:00
• 313f027bc6 ADD: buildcache hash svcusr-spack (Resp. Germann Elsa Sylvia) 2024-06-18 16:43:14 +02:00
• f89fe43f25 FIX: require target sandybridge when using nvhpc svcusr-spack (Resp. Germann Elsa Sylvia) 2024-06-17 13:10:57 +02:00
• 71a78a1014 FIX: nvhpc compiler not finding glibc svcusr-spack (Resp. Germann Elsa Sylvia) 2024-06-17 12:19:17 +02:00
• 76725abe0e FIX: wrong nvhpc path germann_e 2024-06-17 10:55:47 +02:00
• 3ce88b92af ADD: nvhpc@24.3 compiler (stable) germann_e 2024-06-17 10:12:47 +02:00
• cf2b2336d0 FIX: wrong build_stage & install paths germann_e 2024-06-14 11:21:57 +02:00
• 268d51a949 ADD: quantum-espresso to unstable germann_e 2024-06-14 10:24:24 +02:00
• 2e31d9a88f ADD: cp2k@2024+cuda to unstable env germann_e 2024-06-13 16:53:39 +02:00
• b6ccfe456c FIX: add py-numpy requires gcc@12.3.0 germann_e 2024-06-13 15:08:56 +02:00
• c47e6aa34c FIX: doxygen requite gcc@4.8.5 fails -> require %gcc germann_e 2024-06-13 14:15:58 +02:00
• fe2047881a FIX: put correct unstable env matrix specs germann_e 2024-06-13 11:16:05 +02:00
• aa50c8a638 FIX: force makefile build_system for cp2k merlin6 germann_e 2024-06-13 10:36:30 +02:00
• 22ce29b4a9 FIX: slurm pmi-interface variant doesn't exist germann_e 2024-06-13 08:49:08 +02:00
• 21c6a85de5 FIX: remove upstreams for SLES germann_e 2024-06-12 16:04:55 +02:00
• 3708c98da0 ADD: opal@master ^openmpi as testing spec svcusr-spack (Resp. Germann Elsa Sylvia) 2024-06-12 16:01:11 +02:00
• a9d2bfea83 ADD: gcc@=12.3.0 compiler germann_e 2024-06-12 14:08:50 +02:00
• 0d159e73fa FIX: remove upstreams and use almost common buildcache germann_e 2024-06-12 13:43:20 +02:00
• 8526963816 FIX: remove include_concrete germann_e 2024-06-12 08:49:24 +02:00
• 0d0209bbc7 FIX: remove include_concrete germann_e 2024-06-11 14:14:53 +02:00
• bcae1a2631 ADD: gcc@12.3.0 in unstable env germann_e 2024-06-11 08:32:43 +02:00
• 9d12afb089 ADD: gcc@12.3.0 in unstable env rhel7 germann_e 2024-06-11 08:32:43 +02:00
• 187bc51c9a Merge branch 'rhel7' into 'main' germann_e 2024-06-10 17:28:13 +02:00
• 52a322ceed Rhel7 germann_e 2024-06-10 17:28:13 +02:00
• 2968224eab FIX: gettext not buildable with system gcc germann_e 2024-06-10 17:27:50 +02:00
• d3699e1b65 Merge branch 'rhel7' into 'main' germann_e 2024-06-10 17:17:34 +02:00
• 331b563366 FIX: empty spec problem germann_e 2024-06-10 17:17:19 +02:00
• bfe2b73b5d Merge branch 'rhel7' into 'main' germann_e 2024-06-10 17:05:43 +02:00
• 343d9fbd9e FIX: empty spec problem germann_e 2024-06-10 17:05:22 +02:00
• 804c1881f3 Merge branch 'rhel7' into 'main' germann_e 2024-06-10 16:11:51 +02:00
• d40dc9adea FIX: indentation problems germann_e 2024-06-10 16:11:31 +02:00
• 5884766a34 Merge branch 'rhel7' into 'main' germann_e 2024-06-10 15:52:07 +02:00
• b988e13c3f ADD: mirrors germann_e 2024-06-10 15:51:32 +02:00
• 89b0cfca0d Merge branch 'rhel7' into 'main' germann_e 2024-06-10 11:23:27 +02:00
• a5b22ad8f8 ADD: x86_64 sysconfigs and envs germann_e 2024-06-10 11:15:18 +02:00
• 3d94253489 ADD: include_concrete for stable and unstable env germann_e 2024-06-07 20:39:59 +02:00
• bad77c8664 FIX: variable is full path germann_e 2024-06-07 17:21:22 +02:00
• e3ec5668ca ADD: unstable env for users germann_e 2024-06-07 16:59:21 +02:00
• 0cc22999b5 FIX: remove unnecessary env for now germann_e 2024-06-07 16:57:42 +02:00
• 4e3d3332bb FIX: clean restructure germann_e 2024-06-07 16:55:19 +02:00
• 309d54ff17 ADD: admin stable, unstable & testing env germann_e 2024-06-07 16:54:10 +02:00
• bc1a1c1e16 FIX: remove relative path for user stable env germann_e 2024-06-07 12:52:25 +02:00
• 3b2f4008d5 FIX: restructure env germann_e 2024-06-07 12:45:53 +02:00
• 35336f53ef ADD: sysconfigs germann_e 2024-06-07 09:58:26 +02:00
• 1ed5f11250 ADD: stable env germann_e 2024-06-07 08:39:22 +02:00
• 107f3f1d76 FIX: use target for env and add stable env germann_e 2024-06-07 08:34:36 +02:00
• 068efd0c6b ADD: extra version pkgs needed by alphafold germann_e 2024-05-31 12:42:24 +02:00
• d71e6cea13 Update file README.md germann_e 2024-05-29 16:14:57 +02:00
• 85b47c1834 ADD: README.md germann_e 2024-05-29 16:12:46 +02:00
• 729882fb65 ADD: alphafold newest versions germann_e 2024-05-28 10:38:00 +02:00
• dd6456d142 FIX: spack.pkg.builtin.cray_libsci germann_e 2024-05-23 15:24:38 +02:00
• 628cf312d2 ADD: cray-libsci fix germann_e 2024-05-23 09:01:13 +02:00
• 122d03222d FIX: remove harcoded hdf5 and boost version germann_e 2024-05-23 08:47:32 +02:00
• a50e9c6253 FIX: remove openmpi and openblas hardcoded dependency germann_e 2024-05-17 14:44:01 +02:00
• 1295f4db59 ADD: first commit germann_e 2024-05-16 11:01:56 +02:00
• 934b57b1b4 FIX: spack v0.20.0 packages.yaml module error Germann Elsa Sylvia 2023-05-26 11:44:06 +02:00
• e3ab57d525 Merge branch 'update_readme' into 'master' germann_e 2023-05-05 11:52:08 +00:00
• 49ac8bc5de FIX: spack develop modules.yaml problem + install new gromacs with openmpi Germann Elsa Sylvia 2023-05-05 12:53:40 +02:00
• 2c93b42fff Merge branch 'update_readme' into 'master' germann_e 2023-04-27 11:08:07 +00:00
• 1f4913e199 FIX: update README.md Germann Elsa Sylvia 2023-04-27 13:02:10 +02:00
• 8ad522dea8 Merge branch 'prototype' into 'master' germann_e 2023-04-27 08:07:00 +00:00
• adb8e3eb09 Spack Prototype for PSI germann_e 2023-04-27 08:06:59 +00:00
• 8a0d620eb0 Merge branch 'fix_go_pb' into 'master' germann_e 2023-02-27 09:54:16 +00:00
• f2b7b418c0 FIX: fix go version to 1.18 Germann Elsa Sylvia 2023-02-27 09:40:04 +01:00
• 2b3c7b876e Merge branch 'ffbidx' into 'master' germann_e 2022-12-02 10:34:38 +00:00
• 9265090fbb Fixes, docu update stadler_h 2022-12-02 10:27:46 +01:00
• 94c5886498 Update README.md germann_e 2022-11-30 09:30:41 +00:00
• 8a4e4a5d84 Merge branch 'add_cache_cleaning' into 'master' germann_e 2022-11-25 10:32:24 +00:00
• 55d09713fc FIX: add cache cleaning before installation Germann Elsa Sylvia 2022-11-25 10:29:22 +01:00
• 0b817b2f6d Merge branch 'add_ffbidx' into 'master' germann_e 2022-11-24 12:43:24 +00:00
• e4d5ad8aa4 ADD: ffbidx package germann_e 2022-11-24 12:43:23 +00:00
• 6c025154ad Merge branch 'fix_09112022' into 'master' germann_e 2022-11-09 09:19:23 +00:00
• 32565bb057 FIX: add new --add option to install cmd germann_e 2022-11-09 09:12:19 +01:00
• fc68592c6b Merge branch 'add_pipeline' into 'master' germann_e 2022-10-24 10:29:58 +00:00
• 5bba76c3a0 Add pipeline germann_e 2022-10-24 10:29:57 +00:00
• 1dd4db4356 Merge branch 'add_pipeline' into 'master' germann_e 2022-10-19 06:52:45 +00:00
• b51b0ed131 ADD: working pipeline to test HyQuas and HiQsimulator Germann Elsa Sylvia 2022-10-18 16:29:39 +02:00
• c7120345ed RM: +mpi Germann Elsa Sylvia 2022-10-12 15:00:20 +02:00
• 5b667dff78 FIX: change cuda_arch Germann Elsa Sylvia 2022-10-12 11:08:01 +02:00
• 89cd768cf2 FIX: fix the cuda_arch on the fly and create dir Germann Elsa Sylvia 2022-10-11 17:14:15 +02:00
• 437fdc899f FIX: gpu node build Germann Elsa Sylvia 2022-10-11 15:13:16 +02:00
• 7702e47a9d FIX: cp2k installation Germann Elsa Sylvia 2022-10-07 13:36:36 +02:00
• a91f7060d6 ADD: variant to hyquas package Germann Elsa Sylvia 2022-10-07 12:45:19 +02:00
• 6b31f09245 RM: pycache Germann Elsa Sylvia 2022-10-06 13:45:32 +02:00
• 39fcc0edba ADD: HyQuas package Germann Elsa Sylvia 2022-10-06 13:44:45 +02:00
• 74ce767ad6 FIX: py-networkx as run dep of py-projectq Germann Elsa Sylvia 2022-10-05 14:43:19 +02:00
• d135d8cc45 ADD: own version of cp2k (fix oneapi) Germann Elsa Sylvia 2022-10-04 16:01:08 +02:00
• 6a880c9bc5 FIX: add hash to make sure every installation is unique Germann Elsa Sylvia 2022-10-04 15:47:23 +02:00
• aeca31bb98 FIX: add unique python Germann Elsa Sylvia 2022-10-04 15:45:39 +02:00
• 5e3ebeb8dd FIX: typo Germann Elsa Sylvia 2022-10-04 15:44:02 +02:00
• 7e6d72d0f6 ADD: pgi@18.5 compiler Germann Elsa Sylvia 2022-10-04 15:43:01 +02:00