HPCE/spack-psi
0
0
Fork 0
Code Issues Pull Requests Actions Packages Projects Releases Wiki Activity

FIX: clean-up x86_64 admin envs

Browse Source
This commit is contained in:
svcusr-spack (Resp. Germann Elsa Sylvia)
2025-08-19 14:42:26 +02:00
parent e3223c7e05
commit 6213d0a9d6
5 changed files with 51 additions and 182 deletions
Download Patch File Download Diff File Expand all files Collapse all files

2
env/sles15/x86_64/admin/unstable/spack.lock vendored
View File

File diff suppressed because one or more lines are too long

123
env/sles15/x86_64/admin/unstable/spack.yaml vendored
View File

@@ -4,58 +4,6 @@ spack:
config:
install_tree:
root: $spack/opt/spack/unstable
definitions:
- gcc_7.5.0:
- fpart@1.6.0/di4akxx
- castep@25.12/chorual
- gcc_12.3:
- fastqc@0.12.1/eyuqqvf
- ffbidx@main/lfacuhw
- star@2.7.11a/gdgr2ea
- sratoolkit@3.1.1/7oqp6a3
- py-pymol@3.1.0/5qcfphh
- valgrind@3.24.0/eicvdsq
- gcc_13.2:
- dmtcp@3.0.0/e76t6c5
- gams@49.1/vztjqs4
- ghostscript@10.04.0/27dgytn
- ghostscript@10.04.0/sqkkzjs
- nvhpc@25.3/wcwfa56
- libgd@2.3.3/jdywifq
- geant4@11.2.1/nkib2pg
- root@6.34.06/2wo4ykf
- boost@1.82.0/cawp3cu
- arpack-ng@3.9.1/aapiazg
- gcc_13.2_openmpi:
- opal-x@fixSolverUnits/q4ulqv3 #+cuda cuda_arch=80
- opal-x@master/cbgsfxb #+cuda cuda_arch=80
- gcc_12.3_mpich:
- cp2k@2024.1/2jesise #~cuda
- cp2k@2024.1/zqm5fme #+cuda
- relion@4.0.1/ve5sish
- quantum-espresso@7.3.1/n6mulig #~cuda
- opal@2024.1.0/mhg3mdx
- py-alphafold@2.3.2/xkw7tfm #+cuda
- sundials@7.0.0/xxysszi #sundials@7.0.0+ARKODE+CVODE+CVODES+IDA+IDAS+KINSOL+cuda+examples+examples-install~f2003~fcmix~ginkgo~hypre~int64~ipo~klu~kokkos~kokkos-kernels~lapack~magma~monitoring+mpi+openmp~petsc~profiling~pthread~raja~rocm+shared+static~superlu-dist~superlu-mt~sycl~trilinos build_system=cmake build_type=Release cstd=99 cuda_arch=80 cxxstd=14 generator=make logging-level=2 precision=double
- gcc_9.5.0_openmpi:
- q-e-sirius@develop-ristretto/bb4v7wz
- gcc_12.3_openmpi:
- gromacs@2024.1/3n7qspb #+cuda
- hdf5@1.14.3/wqcdnm7 #+mpi ^openmpi@5.0.3%gcc@12.3
- quantum-espresso@7.4.1/qasxcxt
- quantum-espresso@7.4.0/m7bevi7
- gcc_14.2.0_openmpi:
- osu-micro-benchmarks@7.5/tlphstf
- visit@3.4.1/h3a6tat
- gromacs@2025.2/whcqszb
- gromacs@2025.2/vbj4i76
- gcc_14.2.0_mpich:
- osu-micro-benchmarks@7.5/exsxjam
- osu-micro-benchmarks@7.5/miy6mrp
- intel_2021.6.0:
- hdf5@1.14.3/yrxkczx
- nvhpc_23.9_openmpi:
- quantum-espresso@7.4.1/nxswsd7 #+cuda +mpi +mpigpu
include:
- $spack/../spack-psi/env/$os/$target_family/sysconfigs/packages.yaml
include_concrete:
@@ -77,34 +25,45 @@ spack:
set:
SLURM_MPI_TYPE: pmix
specs:
- matrix:
- [$gcc_7.5.0]
- matrix:
- [$gcc_12.3]
- matrix:
- [$gcc_13.2]
- matrix:
- [$gcc_13.2_openmpi]
- [^openmpi]
- matrix:
- [$gcc_12.3_mpich]
- [^cray-mpich]
- matrix:
- [$gcc_14.2.0_mpich]
- [^mpich]
- matrix:
- [$gcc_9.5.0_openmpi]
- [^openmpi]
- matrix:
- [$gcc_14.2.0_openmpi]
- [^openmpi]
- matrix:
- [$gcc_12.3_openmpi]
- [^openmpi]
- matrix:
- [$intel_2021.6.0]
- matrix:
- [$nvhpc_23.9_openmpi]
- [^openmpi]
- valgrind@3.24.0/eicvdsq
- fpart@1.6.0/di4akxx
- castep@25.12/chorual
- fastqc@0.12.1/eyuqqvf
- ffbidx@main/lfacuhw
- star@2.7.11a/gdgr2ea
- sratoolkit@3.1.1/7oqp6a3
- py-pymol@3.1.0/5qcfphh
- valgrind@3.24.0/eicvdsq
- dmtcp@3.0.0/e76t6c5
- gams@49.1/vztjqs4
- ghostscript@10.04.0/27dgytn
- ghostscript@10.04.0/sqkkzjs
- nvhpc@25.3/wcwfa56
- libgd@2.3.3/jdywifq
- geant4@11.2.1/nkib2pg
- root@6.34.06/2wo4ykf
- boost@1.82.0/cawp3cu
- arpack-ng@3.9.1/aapiazg
- opal-x@fixSolverUnits/q4ulqv3 #+cuda cuda_arch=80
- opal-x@master/cbgsfxb #+cuda cuda_arch=80
- cp2k@2024.1/2jesise #~cuda
- cp2k@2024.1/zqm5fme #+cuda
- relion@4.0.1/ve5sish
- quantum-espresso@7.3.1/n6mulig #~cuda
- opal@2024.1.0/mhg3mdx
- py-alphafold@2.3.2/xkw7tfm #+cuda
- sundials@7.0.0/xxysszi #+cuda+mpi+openmp cuda_arch=80
- q-e-sirius@develop-ristretto/bb4v7wz
- gromacs@2024.1/3n7qspb #+cuda
- hdf5@1.14.3/wqcdnm7 #+mpi ^openmpi@5.0.3%gcc@12.3
- quantum-espresso@7.4.1/qasxcxt
- quantum-espresso@7.4.0/m7bevi7
- osu-micro-benchmarks@7.5/tlphstf
- visit@3.4.1/h3a6tat
- gromacs@2025.2/whcqszb
- gromacs@2025.2/vbj4i76
- osu-micro-benchmarks@7.5/exsxjam
- osu-micro-benchmarks@7.5/miy6mrp
- hdf5@1.14.3/yrxkczx
- quantum-espresso@7.4.1/nxswsd7 #+cuda +mpi +mpigpu
- valgrind@3.24.0/eicvdsq
view: false