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

FIX: remove old compilers

Browse Source
This commit is contained in:
Gitea Actions
2025-11-26 11:05:12 +01:00
parent b227d9deba
commit 981e93dae4
4 changed files with 86 additions and 105 deletions
Download Patch File Download Diff File Expand all files Collapse all files

7
env/sles15/aarch64/sysconfigs/packages.yaml vendored
View File

@@ -61,13 +61,6 @@ packages:
- cray-mpich
prefix: /opt/cray/pe/mpich/8.1.28/ofi/gnu/12.3
spec: cray-mpich@8.1.28%gcc@12.3
cray-pmi:
buildable: false
externals:
- modules:
- cray-pmi
prefix: /opt/cray/pe/pmi/6.1.13
spec: cray-pmi@6.1.13%gcc
cuda:
prefer:
- spec: '@12.6.0'

98
env/sles15/x86_64/admin/unstable/spack.yaml vendored
View File

@@ -25,51 +25,55 @@ spack:
set:
SLURM_MPI_TYPE: pmix
specs:
- arpack-ng@3.9.1/aapiazg
- boost@1.82.0/cawp3cu
- castep@25.12/chorual
- cp2k@2024.1/2jesise #~cuda
- cp2k@2024.1/zqm5fme #+cuda
- cp2k@2025.2/yb6gcql #~cuda
- cp2k@2025.2/hkub3ev #+cuda +sirius A100
- dmtcp@3.0.0/e76t6c5
- fastqc@0.12.1/eyuqqvf
- ffbidx@main/lfacuhw
- fpart@1.6.0/di4akxx
- gams@49.1/vztjqs4
- geant4@11.2.1/nkib2pg
- geant4@11.3.2/aumxzp6
- ghostscript@10.04.0/27dgytn
- ghostscript@10.04.0/sqkkzjs
- gromacs@2024.1/3n7qspb #+cuda
- gromacs@2025.2/vbj4i76
- gromacs@2025.2/whcqszb
- hdf5@1.14.3/wqcdnm7 #+mpi ^openmpi@5.0.3%gcc@12.3
- hdf5@1.14.3/yrxkczx
- libgd@2.3.3/jdywifq
- lammps@20250722/37gso73 #~cuda
- lammps@20250722/xcaf2uy #+cuda
- nvhpc@25.3/wcwfa56
- opal-x@fixSolverUnits/q4ulqv3 #+cuda cuda_arch=80
- opal-x@master/cbgsfxb #+cuda cuda_arch=80
- opal@2024.1.0/mhg3mdx
- osu-micro-benchmarks@7.5/exsxjam
- osu-micro-benchmarks@7.5/miy6mrp
- osu-micro-benchmarks@7.5/tlphstf
- py-alphafold@2.3.2/xkw7tfm #+cuda
- py-pymol@3.1.0/5qcfphh
- q-e-sirius@1.0.1/dtn4jr4 #~cuda
- q-e-sirius@1.0.1/7snvzfr #+cuda
- quantum-espresso@7.3.1/n6mulig #~cuda
- quantum-espresso@7.4.0/m7bevi7
- quantum-espresso@7.4.1/nxswsd7 #+cuda +mpi +mpigpu
- quantum-espresso@7.4.1/qasxcxt
- relion@4.0.1/ve5sish
- root@6.34.06/2wo4ykf
- sratoolkit@3.1.1/7oqp6a3
- star@2.7.11a/gdgr2ea
- sundials@7.0.0/xxysszi #+cuda+mpi+openmp cuda_arch=80
- valgrind@3.24.0/eicvdsq
- valgrind@3.24.0/eicvdsq
- visit@3.4.1/h3a6tat
- arpack-ng@3.9.1/aapiazg
- boost@1.82.0/cawp3cu
- castep@25.12/chorual
- cp2k@2024.1/2jesise #~cuda
- cp2k@2024.1/zqm5fme #+cuda
- cp2k@2025.2/yb6gcql #~cuda
- cp2k@2025.2/hkub3ev #+cuda +sirius A100
- dmtcp@3.0.0/e76t6c5
- fastqc@0.12.1/eyuqqvf
- ffbidx@main/lfacuhw
- fpart@1.6.0/di4akxx
- gams@49.1/vztjqs4
- geant4@11.2.1/nkib2pg
- geant4@11.3.2/aumxzp6
- ghostscript@10.04.0/27dgytn
- ghostscript@10.04.0/sqkkzjs
- gromacs@2024.1/3n7qspb #+cuda
- gromacs@2025.2/vbj4i76
- gromacs@2025.2/whcqszb
- gromacs@2025.3/6ken64l
- gromacs@2025.3/ohljtmq #+cuda
- hdf5@1.14.3/wqcdnm7 #+mpi ^openmpi@5.0.3%gcc@12.3
- hdf5@1.14.3/yrxkczx
- intel-oneapi-compilers-classic@2021.6.0 # for rizzi_n, don't remove
- libgd@2.3.3/jdywifq
- lammps@20250722/37gso73 #~cuda
- lammps@20250722/xcaf2uy #+cuda
- nvhpc@25.3/wcwfa56
- opal-x@fixSolverUnits/q4ulqv3 #+cuda cuda_arch=80
- opal-x@master/cbgsfxb #+cuda cuda_arch=80
- opal@2024.1.0/mhg3mdx
- osu-micro-benchmarks@7.5/exsxjam
- osu-micro-benchmarks@7.5/miy6mrp
- osu-micro-benchmarks@7.5/tlphstf
- py-alphafold@2.3.2/xkw7tfm #+cuda
- py-pymol@3.1.0/5qcfphh
- q-e-sirius@1.0.1/dtn4jr4 #~cuda
- q-e-sirius@1.0.1/7snvzfr #+cuda
- quantum-espresso@7.3.1/n6mulig #~cuda
- quantum-espresso@7.4.0/m7bevi7
- quantum-espresso@7.4.1/nxswsd7 #+cuda +mpi +mpigpu
- quantum-espresso@7.4.1/qasxcxt
- relion@4.0.1/ve5sish
- root@6.34.06/2wo4ykf
- scorep@9.3/me7y4yx #+cuda +openmp +shmem +papi
- sratoolkit@3.1.1/7oqp6a3
- star@2.7.11a/gdgr2ea
- sundials@7.0.0/xxysszi #+cuda+mpi+openmp cuda_arch=80
- valgrind@3.24.0/eicvdsq
- valgrind@3.24.0/eicvdsq
- visit@3.4.1/h3a6tat
view: false

82
env/sles15/x86_64/sysconfigs/packages.yaml vendored
View File

@@ -25,26 +25,26 @@ packages:
require: '%gcc'
ca-certificates-mozilla:
require: '%gcc@7.5.0'
# cce:
# externals:
# - modules:
# - libfabric/1.22.0
# - PrgEnv-cray/8.5.0
# - cce/17.0.0
# spec: cce@=17.0.0
# extra_attributes:
# compilers:
# c: cc
# cxx: CC
# fortran: ftn
# operating_system: sles15
# target: x86_64
cce:
externals:
- modules:
- libfabric/1.22.0
- PrgEnv-cray/8.5.0
- cce/17.0.0
spec: cce@=17.0.0
extra_attributes:
compilers:
c: cc
cxx: CC
fortran: ftn
operating_system: sles15
target: x86_64
cairo:
require: '%gcc@7.5.0'
cassini-headers:
require: '@12.0.1'
cmake:
require: '^gcc'
require: '%gcc'
coreutils:
require: '%gcc@7.5.0'
cray-mpich:
@@ -59,18 +59,11 @@ packages:
- cray-mpich
- libfabric/1.22.0
prefix: /opt/cray/pe/mpich/8.1.28/ofi/gnu/12.3
spec: cray-mpich@8.1.28^gcc@12.3
cray-pmi:
buildable: false
externals:
- modules:
- cray-pmi
prefix: /opt/cray/pe/pmi/6.1.13
spec: cray-pmi@6.1.13^gcc
spec: cray-mpich@8.1.28%gcc@12.3
cuda:
prefer:
- spec: '@12.6.0'
require: '@12.2.0:'
#require: '@12.2.0:'
curl:
require: '%gcc@7.5.0'
cxi-driver:
@@ -103,20 +96,6 @@ packages:
c: /usr/bin/gcc-12
cxx: /usr/bin/g++-12
fortran: /usr/bin/gfortran-12
- spec: gcc@=13.2.0 languages='c,c++,fortran'
prefix: /afs/psi.ch/sys/spack/0.22.0/opt/spack/stable/linux-sles15-x86_64/gcc-7.5.0/gcc-13.2.0-2k3w3v2u5u6bfnoxl5rgnnna4on3lku7
extra_attributes:
compilers:
c: /afs/psi.ch/sys/spack/0.22.0/opt/spack/stable/linux-sles15-x86_64/gcc-7.5.0/gcc-13.2.0-2k3w3v2u5u6bfnoxl5rgnnna4on3lku7/bin/gcc
cxx: /afs/psi.ch/sys/spack/0.22.0/opt/spack/stable/linux-sles15-x86_64/gcc-7.5.0/gcc-13.2.0-2k3w3v2u5u6bfnoxl5rgnnna4on3lku7/bin/g++
fortran: /afs/psi.ch/sys/spack/0.22.0/opt/spack/stable/linux-sles15-x86_64/gcc-7.5.0/gcc-13.2.0-2k3w3v2u5u6bfnoxl5rgnnna4on3lku7/bin/gfortran
- spec: gcc@=9.5.0 languages='c,c++,fortran'
prefix: /afs/psi.ch/sys/spack/0.23.0/opt/spack/unstable/linux-sles15-x86_64/gcc-7.5.0/gcc-9.5.0-ow3yhuibzp7u753hyh5xngfgegxgijxp
extra_attributes:
compilers:
c: /afs/psi.ch/sys/spack/0.23.0/opt/spack/unstable/linux-sles15-x86_64/gcc-7.5.0/gcc-9.5.0-ow3yhuibzp7u753hyh5xngfgegxgijxp/bin/gcc
cxx: /afs/psi.ch/sys/spack/0.23.0/opt/spack/unstable/linux-sles15-x86_64/gcc-7.5.0/gcc-9.5.0-ow3yhuibzp7u753hyh5xngfgegxgijxp/bin/g++
fortran: /afs/psi.ch/sys/spack/0.23.0/opt/spack/unstable/linux-sles15-x86_64/gcc-7.5.0/gcc-9.5.0-ow3yhuibzp7u753hyh5xngfgegxgijxp/bin/gfortran
- spec: gcc@=14.2.0 languages='c,c++,fortran'
prefix: /afs/psi.ch/sys/spack/develop/opt/spack/unstable/linux-sles15-x86_64/gcc-7.5.0/gcc-14.2.0-jzgck7w35mj62amibctygaltet3udp7k
extra_attributes:
@@ -154,21 +133,22 @@ packages:
require: 'default_library=shared,static'
intel-oneapi-compilers:
externals:
- spec: intel-oneapi-compilers@2022.1.0
prefix: /afs/psi.ch/sys/spack/0.22.0/opt/spack/stable/linux-sles15-x86_64/gcc-7.5.0/intel-oneapi-compilers-2022.1.0-bf6lcbnmvgeb57jaihsfu22xlbgmmqe7
extra_attributes:
compilers:
c: /afs/psi.ch/sys/spack/0.22.0/opt/spack/stable/linux-sles15-x86_64/gcc-7.5.0/intel-oneapi-compilers-2022.1.0-bf6lcbnmvgeb57jaihsfu22xlbgmmqe7/compiler/2022.1.0/linux/bin/icx
cxx: /afs/psi.ch/sys/spack/0.22.0/opt/spack/stable/linux-sles15-x86_64/gcc-7.5.0/intel-oneapi-compilers-2022.1.0-bf6lcbnmvgeb57jaihsfu22xlbgmmqe7/compiler/2022.1.0/linux/bin/icpx
- spec: intel-oneapi-compilers@2022.1.0
prefix: /afs/psi.ch/sys/spack/develop/opt/spack/unstable/linux-x86_64/intel-oneapi-compilers-2022.1.0-b2f5stwvjqhe6hknspnzt4a62iz54bzp
extra_attributes:
compilers:
c: /afs/psi.ch/sys/spack/develop/opt/spack/unstable/linux-x86_64/intel-oneapi-compilers-2022.1.0-b2f5stwvjqhe6hknspnzt4a62iz54bzp/compiler/2022.1.0/linux/bin/icx
cxx: /afs/psi.ch/sys/spack/develop/opt/spack/unstable/linux-x86_64/intel-oneapi-compilers-2022.1.0-b2f5stwvjqhe6hknspnzt4a62iz54bzp/compiler/2022.1.0/linux/bin/icpx
fortran: /afs/psi.ch/sys/spack/develop/opt/spack/unstable/linux-x86_64/intel-oneapi-compilers-2022.1.0-b2f5stwvjqhe6hknspnzt4a62iz54bzp/compiler/2022.1.0/linux/bin/ifx
intel-oneapi-compilers-classic:
externals:
- spec: intel-oneapi-compilers-classic@2021.6.0
prefix: /afs/psi.ch/sys/spack/0.22.0/opt/spack/stable/linux-sles15-x86_64/gcc-7.5.0/intel-oneapi-compilers-2022.1.0-bf6lcbnmvgeb57jaihsfu22xlbgmmqe7/compiler/2022.1.0/linux
extra_attributes:
compilers:
c: /afs/psi.ch/sys/spack/0.22.0/opt/spack/stable/linux-sles15-x86_64/gcc-7.5.0/intel-oneapi-compilers-2022.1.0-bf6lcbnmvgeb57jaihsfu22xlbgmmqe7/compiler/2022.1.0/linux/bin/intel64/icc
cxx: /afs/psi.ch/sys/spack/0.22.0/opt/spack/stable/linux-sles15-x86_64/gcc-7.5.0/intel-oneapi-compilers-2022.1.0-bf6lcbnmvgeb57jaihsfu22xlbgmmqe7/compiler/2022.1.0/linux/bin/intel64/icpc
fortran: /afs/psi.ch/sys/spack/0.22.0/opt/spack/stable/linux-sles15-x86_64/gcc-7.5.0/intel-oneapi-compilers-2022.1.0-bf6lcbnmvgeb57jaihsfu22xlbgmmqe7/compiler/2022.1.0/linux/bin/intel64/ifort
- spec: intel-oneapi-compilers-classic@2021.6.0
prefix: /afs/psi.ch/sys/spack/develop/opt/spack/unstable/linux-x86_64/intel-oneapi-compilers-2022.1.0-b2f5stwvjqhe6hknspnzt4a62iz54bzp/compiler/2022.1.0/linux
extra_attributes:
compilers:
c: /afs/psi.ch/sys/spack/develop/opt/spack/unstable/linux-x86_64/intel-oneapi-compilers-2022.1.0-b2f5stwvjqhe6hknspnzt4a62iz54bzp/compiler/2022.1.0/linux/bin/intel64/icc
cxx: /afs/psi.ch/sys/spack/develop/opt/spack/unstable/linux-x86_64/intel-oneapi-compilers-2022.1.0-b2f5stwvjqhe6hknspnzt4a62iz54bzp/compiler/2022.1.0/linux/bin/intel64/icpc
fortran: /afs/psi.ch/sys/spack/develop/opt/spack/unstable/linux-x86_64/intel-oneapi-compilers-2022.1.0-b2f5stwvjqhe6hknspnzt4a62iz54bzp/compiler/2022.1.0/linux/bin/intel64/ifort
libbsd:
require: '%gcc@7.5.0'
libcxi: