spack:
  concretizer:
    unify: false
  config:
    install_tree:
      root: $spack/opt/spack/unstable
  definitions:
  - gcc_12.3_mpich:
    - cp2k@2024.1/2jesise     #~cuda
    - cp2k@2024.1/zqm5fme     #+cuda
    - quantum-espresso@7.3.1/n6mulig     #~cuda
    - opal@2024.1.0/mhg3mdx
    - py-alphafold@2.3.2/xkw7tfm     #+cuda
  - gcc_12.3_openmpi:
    - gromacs@2024.1/3n7qspb     #+cuda
  - nvhpc_23.9_openmpi:
    - quantum-espresso@7.3.1/le35al7 #+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: $spack/opt/spack/unstable/modulefiles
  specs:
  - matrix:
    - [$gcc_12.3_mpich]
    - ['%gcc@12.3']
    - [^cray-mpich]
  - matrix:
    - [$gcc_12.3_openmpi]
    - ['%gcc@12.3']
    - [^openmpi]
  - matrix:
    - [$nvhpc_23.9_openmpi]
    - ['%nvhpc@23.9']
    - [^openmpi]
  view: false