spack:
  concretizer:
    unify: false
  config:
    install_tree:
      root: $spack/opt/spack/unstable
  definitions:
  - gcc_7.5.0:
    - ffbidx@main/3xig2i
  - gcc_12.3_mpich:
    - cp2k@2024.1/zqm5fme     #+cuda
    - py-alphafold@2.3.2/xkw7tfm     #+cuda
  - gcc_12.3_openmpi:
    - gromacs@2024.1/x33hfjx
  - nvhpc_24.3_openmpi:
    - quantum-espresso@7.3.1/ilkc3ds #+cuda
  include:
  - $spack/../spack-psi/env/$os/$target_family/sysconfigs/packages.yaml
  - $spack/../spack-psi/env/$os/$target_family/sysconfigs/compilers.yaml
  mirrors:
    local_psi: file:///afs/psi.ch/software/spack/testing
  modules:
    default:
      roots:
        tcl: $spack/opt/spack/unstable/modulefiles
      tcl:
        cray-mpich:
          environment:
            set:
              SLURM_MPI_TYPE: 'pmix'
        openmpi:
          environment:
            set:
              SLURM_MPI_TYPE: 'pmix'
  specs:
  - matrix:
    - [$gcc_7.5.0]
    - ['%gcc@7.5.0']
  - matrix:
    - [$gcc_12.3_mpich]
    - ['%gcc@12.3']
    - [^cray-mpich]
  - matrix:
    - [$gcc_12.3_openmpi]
    - ['%gcc@12.3']
    - [^openmpi]
  - matrix:
    - [$nvhpc_24.3_openmpi]
    - ['%nvhpc@24.3']
    - [^openmpi]
  view: false