FIX: remove openmpi%nvhpc because it fails
This commit is contained in:
38
env/merlin/spack.yaml
vendored
38
env/merlin/spack.yaml
vendored
@ -2,7 +2,7 @@ spack:
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concretizer:
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unify: false
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definitions:
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- Compilers: &Compilers
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- Compilers:
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- '%clang@12.0.0'
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- '%dpcpp@2022.1.0'
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- '%gcc@12.1.0'
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@ -11,9 +11,9 @@ spack:
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- '%oneapi@2022.1.0'
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# Careful!! Any external packages shouldn't be placed here, otherwise there is a possibility
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# they'll end with a module pointing to empty paths!!
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- Batchsystem_pckgs: &Batchsystem_pckgs
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- Batchsystem_pckgs:
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- slurm
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- Compiler_pckgs: &Compiler_pckgs
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- Compiler_pckgs:
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- atlas
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- boost
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- clapack
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@ -34,15 +34,15 @@ spack:
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- root
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- superlu
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- vtk
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- Cuda_pckgs: &Cuda_pckgs
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- Cuda_pckgs:
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- cuda
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- EM_pckgs: &EM_pckgs
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- EM_pckgs:
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- cistem
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- ctffind
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- motioncor2
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- relion
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- unblur
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- Librairies_pckgs: &Librairies_pckgs
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- Librairies_pckgs:
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- alsa-lib
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- gdrcopy
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- giflib
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@ -60,12 +60,12 @@ spack:
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- wxwidgets
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- x264
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- zlib
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- MX_pckgs: &MX_pckgs
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- MX_pckgs:
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- cbflib
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- lz4
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- openbabel
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- visit
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- HDF5_pckgs: &HDF5_pckgs
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- HDF5_pckgs:
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- alps
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- h5hut+mpi
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- hdf5-blosc
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@ -75,11 +75,11 @@ spack:
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- netcdf-fortran
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- netcdf-c +parallel-netcdf
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- trilinos
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- HDF5_serial_pckgs: &HDF5_serial_pckgs
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- HDF5_serial_pckgs:
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- hdf5~mpi
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- h5hut~mpi
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- ncview
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- MPI_pckgs: &MPI_pckgs
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- MPI_pckgs:
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- amrex
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- boxlib
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- cp2k
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@ -90,7 +90,7 @@ spack:
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- gromacs
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- lammps
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- astra
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- Programming_pckgs: &Programming_pckgs
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- Programming_pckgs:
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- autoconf
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- automake
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- binutils
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@ -114,7 +114,7 @@ spack:
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- r
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- tcl
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- tk
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- System_pckgs: &System_pckgs
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- System_pckgs:
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- bash
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- filebench
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- ior
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@ -122,7 +122,7 @@ spack:
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- nmap
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- patchelf
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- unison
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- Tools_pckgs: &Tools_pckgs
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- Tools_pckgs:
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- aria2
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- asciidoc
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- coreutils
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@ -545,18 +545,18 @@ spack:
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#<<<
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specs:
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- matrix:
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- [cmake,cuda,fftw,gromacs,kokkos,mpich netmod=ucx,nvhpc,openblas threads=none,openblas threads=openmp,
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- [cmake,cuda,fftw,gromacs,kokkos,mpich netmod=ucx,nvhpc+mpi,openblas threads=none,openblas threads=openmp,
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python,root~tbb~x,slurm,gsl]
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- ['%gcc']
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- matrix:
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- [boost, hdf5~mpi, openmpi]
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- [boost]
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- ['%clang','%gcc','%nvhpc','%oneapi']
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exclude:
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- hdf5~mpi%clang
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- openmpi%clang
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- matrix:
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- [hdf5~mpi, openmpi]
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- ['%gcc','%oneapi']
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- matrix:
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- [hdf5+mpi +fortran +hl +shared, netcdf-fortran, netcdf-c +parallel-netcdf]
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- ['%gcc','%nvhpc','%oneapi']
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- ['%gcc','%oneapi']
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- [^openmpi]
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- intel-oneapi-mpi%oneapi
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view:
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