spack: concretizer: unify: false config: install_tree: root: $spack/opt/spack/unstable definitions: - gcc_7.5.0: - visit@3.3.3/fo37wwb - gcc_12.3: - fastqc@0.12.1/eyuqqvf - ffbidx@main/lfacuhw - star@2.7.11a/gdgr2ea - sratoolkit@3.1.1/7oqp6a3 - 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 - intel_2021.6.0: - openmpi@4.1.6/eqhrgv5 - 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_7.5.0] - ['%gcc@7.5.0'] - matrix: - [$gcc_12.3] - ['%gcc@12.3'] - matrix: - [$gcc_12.3_mpich] - ['%gcc@12.3'] - [^cray-mpich] - matrix: - [$gcc_12.3_openmpi] - ['%gcc@12.3'] - [^openmpi] - matrix: - [$intel_2021.6.0] - ['%intel@2021.6.0'] - matrix: - [$nvhpc_23.9_openmpi] - ['%nvhpc@23.9'] - [^openmpi] view: false