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FIX: remove openmpi%nvhpc because it fails

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This commit is contained in:
Germann Elsa Sylvia
2022-08-29 12:49:16 +02:00
parent c7972614b6
commit 4635edb20d
1 changed files with 156 additions and 156 deletions
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312
env/merlin/spack.yaml vendored
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@ -2,159 +2,159 @@ spack:
concretizer:
unify: false
definitions:
- Compilers: &Compilers
- '%clang@12.0.0'
- '%dpcpp@2022.1.0'
- '%gcc@12.1.0'
- '%intel@2021.6.0'
- '%nvhpc@21.5'
- '%oneapi@2022.1.0'
- Compilers:
- '%clang@12.0.0'
- '%dpcpp@2022.1.0'
- '%gcc@12.1.0'
- '%intel@2021.6.0'
- '%nvhpc@21.5'
- '%oneapi@2022.1.0'
# Careful!! Any external packages shouldn't be placed here, otherwise there is a possibility
# they'll end with a module pointing to empty paths!!
- Batchsystem_pckgs: &Batchsystem_pckgs
- slurm
- Compiler_pckgs: &Compiler_pckgs
- atlas
- boost
- clapack
- clhep
- eigen
- geant4
- googletest
- gsl
- intel-oneapi-mpi
- kokkos
- libint tune=cp2k-lmax-6
- libxc
- libxsmm
- mpich
- openblas threads=none
- openblas threads=openmp
- openmpi
- root
- superlu
- vtk
- Cuda_pckgs: &Cuda_pckgs
- cuda
- EM_pckgs: &EM_pckgs
- cistem
- ctffind
- motioncor2
- relion
- unblur
- Librairies_pckgs: &Librairies_pckgs
- alsa-lib
- gdrcopy
- giflib
- gmp
- hwloc
- isl
- knem
- libtasn1
- mpc
- mpfr
- nettle
- pmix
- ucx
- udunits
- wxwidgets
- x264
- zlib
- MX_pckgs: &MX_pckgs
- cbflib
- lz4
- openbabel
- visit
- HDF5_pckgs: &HDF5_pckgs
- alps
- h5hut+mpi
- hdf5-blosc
- ioapi
- hdf5+mpi
- netcdf-c
- netcdf-fortran
- netcdf-c +parallel-netcdf
- trilinos
- HDF5_serial_pckgs: &HDF5_serial_pckgs
- hdf5~mpi
- h5hut~mpi
- ncview
- MPI_pckgs: &MPI_pckgs
- amrex
- boxlib
- cp2k
- cpmd
- elegant
- elpa
- fftw
- gromacs
- lammps
- astra
- Programming_pckgs: &Programming_pckgs
- autoconf
- automake
- binutils
- bison
- cmake
- erlang
- gcc
- go
- intel
- openjdk
- julia
- libtool
- lua
- m4
- nasm
- perl
- nvhpc
- python
- py-tensorflow
- qt
- r
- tcl
- tk
- System_pckgs: &System_pckgs
- bash
- filebench
- ior
- mdtest
- nmap
- patchelf
- unison
- Tools_pckgs: &Tools_pckgs
- aria2
- asciidoc
- coreutils
- emacs
- ffmpeg
- gaussian
- gettext
- git
- global
- gnupg
- gnuplot
- gnutls
- hdfview
- krb5
- kubernetes
- namd
- ncview
- openjpeg
- openssl
- orca
- paraview
- texlive
- tmux
- uncrustify
- vim
- visit
- xmlto
- xz
- Batchsystem_pckgs:
- slurm
- Compiler_pckgs:
- atlas
- boost
- clapack
- clhep
- eigen
- geant4
- googletest
- gsl
- intel-oneapi-mpi
- kokkos
- libint tune=cp2k-lmax-6
- libxc
- libxsmm
- mpich
- openblas threads=none
- openblas threads=openmp
- openmpi
- root
- superlu
- vtk
- Cuda_pckgs:
- cuda
- EM_pckgs:
- cistem
- ctffind
- motioncor2
- relion
- unblur
- Librairies_pckgs:
- alsa-lib
- gdrcopy
- giflib
- gmp
- hwloc
- isl
- knem
- libtasn1
- mpc
- mpfr
- nettle
- pmix
- ucx
- udunits
- wxwidgets
- x264
- zlib
- MX_pckgs:
- cbflib
- lz4
- openbabel
- visit
- HDF5_pckgs:
- alps
- h5hut+mpi
- hdf5-blosc
- ioapi
- hdf5+mpi
- netcdf-c
- netcdf-fortran
- netcdf-c +parallel-netcdf
- trilinos
- HDF5_serial_pckgs:
- hdf5~mpi
- h5hut~mpi
- ncview
- MPI_pckgs:
- amrex
- boxlib
- cp2k
- cpmd
- elegant
- elpa
- fftw
- gromacs
- lammps
- astra
- Programming_pckgs:
- autoconf
- automake
- binutils
- bison
- cmake
- erlang
- gcc
- go
- intel
- openjdk
- julia
- libtool
- lua
- m4
- nasm
- perl
- nvhpc
- python
- py-tensorflow
- qt
- r
- tcl
- tk
- System_pckgs:
- bash
- filebench
- ior
- mdtest
- nmap
- patchelf
- unison
- Tools_pckgs:
- aria2
- asciidoc
- coreutils
- emacs
- ffmpeg
- gaussian
- gettext
- git
- global
- gnupg
- gnuplot
- gnutls
- hdfview
- krb5
- kubernetes
- namd
- ncview
- openjpeg
- openssl
- orca
- paraview
- texlive
- tmux
- uncrustify
- vim
- visit
- xmlto
- xz
include:
- sysconfigs/config.yaml
- sysconfigs/compilers.yaml
- sysconfigs/packages.yaml
- sysconfigs/config.yaml
- sysconfigs/compilers.yaml
- sysconfigs/packages.yaml
#>>> modules.yaml
modules:
Batchsystem:
@ -545,18 +545,18 @@ spack:
#<<<
specs:
- matrix:
- [cmake,cuda,fftw,gromacs,kokkos,mpich netmod=ucx,nvhpc,openblas threads=none,openblas threads=openmp,
- [cmake,cuda,fftw,gromacs,kokkos,mpich netmod=ucx,nvhpc+mpi,openblas threads=none,openblas threads=openmp,
python,root~tbb~x,slurm,gsl]
- ['%gcc']
- matrix:
- [boost, hdf5~mpi, openmpi]
- [boost]
- ['%clang','%gcc','%nvhpc','%oneapi']
exclude:
- hdf5~mpi%clang
- openmpi%clang
- matrix:
- [hdf5~mpi, openmpi]
- ['%gcc','%oneapi']
- matrix:
- [hdf5+mpi +fortran +hl +shared, netcdf-fortran, netcdf-c +parallel-netcdf]
- ['%gcc','%nvhpc','%oneapi']
- ['%gcc','%oneapi']
- [^openmpi]
- intel-oneapi-mpi%oneapi
view: