From dbd040bbbdc6dbedd04e96b204ea61a46f513f1f Mon Sep 17 00:00:00 2001 From: Germann Elsa Sylvia Date: Tue, 30 Aug 2022 09:19:36 +0200 Subject: [PATCH] ADD: testing of compiler pckgs --- env/merlin/spack.yaml | 61 ++++++++++++++++++------------------------- 1 file changed, 25 insertions(+), 36 deletions(-) diff --git a/env/merlin/spack.yaml b/env/merlin/spack.yaml index 7fefdad..119750e 100644 --- a/env/merlin/spack.yaml +++ b/env/merlin/spack.yaml @@ -14,26 +14,29 @@ spack: - 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 + # - atlas E.G: removing atlas from testing, since it taking way too much time. Installation working though. + - boost%gcc + - boost%oneapi + - boost%clang + - boost%nvhpc + - clapack%gcc + - clhep%gcc + - eigen%gcc + - geant4%gcc + - googletest%gcc + - gsl%gcc + - intel-oneapi-mpi%oneapi + - kokkos%gcc + - libint%oneapi tune=cp2k-lmax-6 + - libxc%oneapi + - libxsmm%oneapi + - mpich%gcc netmod=ucx + - openblas%gcc threads=none + - openblas%gcc threads=openmp + - openmpi%gcc + - root%gcc + - superlu%gcc + - vtk%gcc - Cuda_pckgs: &Cuda_pckgs - cuda - EM_pckgs: &EM_pckgs @@ -107,7 +110,7 @@ spack: - m4 - nasm - perl - - nvhpc + - nvhpc+mpi - python - py-tensorflow - qt @@ -544,21 +547,7 @@ spack: - PKG_CONFIG_PATH #<<< specs: - - matrix: - - [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] - - ['%clang','%gcc','%nvhpc','%oneapi'] - - matrix: - - [hdf5~mpi, openmpi] - - ['%gcc','%oneapi'] - - matrix: - - [hdf5+mpi +fortran +hl +shared, netcdf-fortran, netcdf-c +parallel-netcdf] - - ['%gcc','%oneapi'] - - [^openmpi] - - intel-oneapi-mpi%oneapi + - $Compiler_pckgs view: Batchsystem: link: all