spack-psi/env/merlin/spack.yaml

spack:
  concretizer:
    unify: false
#>>> config.yaml
  config:
    build_stage:
      - /scratch/spack-rhel7
    install_tree:
      root: /scratch/spack-rhel7/spack-install
#<<<
  definitions:
    - compilers:
        - '%gcc@12.1.0'
    - Batchsystem_pckgs: &Batchsystem_pckgs
        - slurm
    - Compilers_pckgs: &Compilers_pckgs
        - atlas
        - boost
        - clapack
        - clhep
        - cuda
        - eigen
        - geant4
        - gsl
        - googletest
        - hdf5~mpi
        - hdf5+mpi
        - kokkos
        - libint tune=cp2k-lmax-6
        - libxc
        - libxsmm
        - mpich
        - nvhpc+mpi
        - openblas threads=none
        - openblas threads=openmp
        - openmpi
        - root
        - superlu
        - vtk
    - Cuda_pckgs: &Cuda_pckgs
        - cuda
    - EM_pckgs: &EM_pckgs
        - cistem
        - ctffind
        - motioncor2
        - relion
        - unblur
    - Librairies_pckgs: &Librairies_pckgs
        - alsa-lib
        - gdrcopy
        - giflib
        - gmp
        - hwloc
        - isl
        - knem
        - libtasn1
        - mpc
        - mpfr
        - nettle
        - pmix
        - ucx
        - udunits
        - wxwidgets
        - x264
        - zlib
    - MX_pckgs: &MX_pckgs
        - cbflib
        - lz4
        - openbabel
        - visit
    - HDF5_pckgs: &HDF5_pckgs
        - alps
        - h5hut+mpi
        - hdf5-blosc
        - ioapi
        - netcdf-c
        - netcdf-fortran
        - netcdf-c +parallel-netcdf
        - trilinos
    - HDF5_serial_pckgs: &HDF5_serial_pckgs
        - h5hut~mpi
        - ncview
    - MPI_pckgs: &MPI_pckgs
        - amrex
        - boxlib
        - cp2k
        - cpmd
        - elegant
        - elpa
        - fftw
        - gromacs
        - lammps
        - astra
    - Programming_pckgs: &Programming_pckgs
        - autoconf
        - automake
        - binutils
        - bison
        - cmake
        - erlang
        - gcc
        - go
        - intel-oneapi-mpi
        - intel
        - openjdk
        - julia
        - libtool
        - lua
        - m4
        - nasm
        - perl
        - nvhpc
        - python
        - py-tensorflow
        - qt
        - r
        - tcl
        - tk
    - System_pckgs: &System_pckgs
        - bash
        - filebench
        - ior
        - mdtest
        - nmap
        - patchelf
        - unison
    - Tools_pckgs: &Tools_pckgs
        - aria2
        - asciidoc
        - coreutils
        - emacs
        - ffmpeg
        - gaussian
        - gettext
        - git
        - global
        - gnupg
        - gnuplot
        - gnutls
        - hdfview
        - krb5
        - kubernetes
        - namd
        - ncview
        - openjpeg
        - openssl
        - orca
        - paraview
        - texlive
        - tmux
        - uncrustify
        - vim
        - visit
        - xmlto
        - xz
  include:
    - sysconfigs/compilers.yaml
    - sysconfigs/packages.yaml
#>>> modules.yaml
  modules:
    Batchsystem:
      use_view: Batchsystem
      arch_folder: false
      enable:
      - tcl
      roots:
        tcl: /afs/psi.ch/sys/spack-rhel7/Batchsystem
      tcl:
        blacklist_implicits: true
        include: *Batchsystem_pckgs
        all:
          autoload: direct
          conflict:
            - '{name}'
          environment:
            set:
              ${PACKAGE}_INCLUDE_DIR: '{prefix}/include'
              ${PACKAGE}_LIBRARY_DIR: '{prefix}/lib'
              ${PACKAGE}_VERSION: '{version}'
        projections: &unified_modules_projections
          all: modulefiles/{compiler.name}/{compiler.version}/{name}/{version}
          ^mpi: 'modulefiles/{compiler.name}/{compiler.version}/{name}/{version}/{^mpi.name}/{^mpi.version}'
          ~mpi: 'modulefiles/{compiler.name}/{compiler.version}/{name}_serial/{version}'
    Compilers:
      use_view: Compilers
      arch_folder: false
      enable:
      - tcl
      roots:
        tcl: /afs/psi.ch/sys/spack-rhel7/Compilers
      tcl:
        blacklist_implicits: true
        include: *Compilers_pckgs
        all:
          autoload: direct
          conflict:
            - '{name}'
          environment:
            set:
              ${PACKAGE}_INCLUDE_DIR: '{prefix}/include'
              ${PACKAGE}_LIBRARY_DIR: '{prefix}/lib'
              ${PACKAGE}_VERSION: '{version}'
        projections: *unified_modules_projections
    Cuda:
      use_view: Cuda
      arch_folder: false
      enable:
      - tcl
      roots:
        tcl: /afs/psi.ch/sys/spack-rhel7/cuda
      tcl:
        blacklist_implicits: true
        include: *Cuda_pckgs
        all:
          autoload: direct
          conflict:
            - '{name}'
          environment:
            set:
              ${PACKAGE}_INCLUDE_DIR: '{prefix}/include'
              ${PACKAGE}_LIBRARY_DIR: '{prefix}/lib'
              ${PACKAGE}_VERSION: '{version}'
        projections: *unified_modules_projections
    EM:
      use_view: EM
      arch_folder: false
      enable:
      - tcl
      roots:
        tcl: /afs/psi.ch/sys/spack-rhel7/EM
      tcl:
        blacklist_implicits: true
        include: *EM_pckgs
        all:
          autoload: direct
          conflict:
            - '{name}'
          environment:
            set:
              ${PACKAGE}_INCLUDE_DIR: '{prefix}/include'
              ${PACKAGE}_LIBRARY_DIR: '{prefix}/lib'
              ${PACKAGE}_VERSION: '{version}'
        projections: *unified_modules_projections
    HDF5:
      use_view: HDF5
      arch_folder: false
      enable:
      - tcl
      roots:
        tcl: /afs/psi.ch/sys/spack-rhel7/HDF5
      tcl:
        blacklist_implicits: true
        include: *HDF5_pckgs
        all:
          autoload: direct
          conflict:
            - '{name}'
            - 'HDF5_serial'
          environment:
            set:
              ${PACKAGE}_INCLUDE_DIR: '{prefix}/include'
              ${PACKAGE}_LIBRARY_DIR: '{prefix}/lib'
              ${PACKAGE}_VERSION: '{version}'
        projections: *unified_modules_projections
    HDF5_serial:
      use_view: HDF5_serial
      arch_folder: false
      enable:
      - tcl
      roots:
        tcl: /afs/psi.ch/sys/spack-rhel7/HDF5_serial
      tcl:
        blacklist_implicits: true
        include: *HDF5_serial_pckgs
        all:
          autoload: direct
          conflict:
            - '{name}'
            - 'HDF5_serial'
          environment:
            set:
              ${PACKAGE}_INCLUDE_DIR: '{prefix}/include'
              ${PACKAGE}_LIBRARY_DIR: '{prefix}/lib'
              ${PACKAGE}_VERSION: '{version}'
        projections: *unified_modules_projections
    Librairies:
      use_view: Librairies
      arch_folder: false
      enable:
      - tcl
      roots:
        tcl: /afs/psi.ch/sys/spack-rhel7/Librairies
      tcl:
        blacklist_implicits: true
        include: *Librairies_pckgs
        all:
          autoload: direct
          conflict:
            - '{name}'
          environment:
            set:
              ${PACKAGE}_INCLUDE_DIR: '{prefix}/include'
              ${PACKAGE}_LIBRARY_DIR: '{prefix}/lib'
              ${PACKAGE}_VERSION: '{version}'
        projections: *unified_modules_projections
    MPI:
      use_view: MPI
      arch_folder: false
      enable:
      - tcl
      roots:
        tcl: /afs/psi.ch/sys/spack-rhel7/MPI
      tcl:
        blacklist_implicits: true
        include: *MPI_pckgs
        all:
          autoload: direct
          conflict:
            - '{name}'
          environment:
            set:
              ${PACKAGE}_INCLUDE_DIR: '{prefix}/include'
              ${PACKAGE}_LIBRARY_DIR: '{prefix}/lib'
              ${PACKAGE}_VERSION: '{version}'
        projections: *unified_modules_projections
    MX:
      use_view: MX
      arch_folder: false
      enable:
      - tcl
      roots:
        tcl: /afs/psi.ch/sys/spack-rhel7/MX
      tcl:
        blacklist_implicits: true
        include: *MX_pckgs
        all:
          autoload: direct
          conflict:
            - '{name}'
          environment:
            set:
              ${PACKAGE}_INCLUDE_DIR: '{prefix}/include'
              ${PACKAGE}_LIBRARY_DIR: '{prefix}/lib'
              ${PACKAGE}_VERSION: '{version}'
        projections: *unified_modules_projections
    Programming:
      use_view: Programming
      arch_folder: false
      enable:
      - tcl
      roots:
        tcl: /afs/psi.ch/sys/spack-rhel7/Programming
      tcl:
        blacklist_implicits: true
        include: *Programming_pckgs
        all:
          autoload: direct
          conflict:
            - '{name}'
          environment:
            set:
              ${PACKAGE}_INCLUDE_DIR: '{prefix}/include'
              ${PACKAGE}_LIBRARY_DIR: '{prefix}/lib'
              ${PACKAGE}_VERSION: '{version}'
        projections: *unified_modules_projections
    System:
      use_view: System
      arch_folder: false
      enable:
      - tcl
      roots:
        tcl: /afs/psi.ch/sys/spack-rhel7/System
      tcl:
        blacklist_implicits: true
        include: *System_pckgs
        all:
          autoload: direct
          conflict:
            - '{name}'
          environment:
            set:
              ${PACKAGE}_INCLUDE_DIR: '{prefix}/include'
              ${PACKAGE}_LIBRARY_DIR: '{prefix}/lib'
              ${PACKAGE}_VERSION: '{version}'
        projections: *unified_modules_projections
    Tools:
      use_view: Tools
      arch_folder: false
      enable:
      - tcl
      roots:
        tcl: /afs/psi.ch/sys/spack-rhel7/Tools
      tcl:
        blacklist_implicits: true
        include: *Tools_pckgs
        all:
          autoload: direct
          conflict:
            - '{name}'
          environment:
            set:
              ${PACKAGE}_INCLUDE_DIR: '{prefix}/include'
              ${PACKAGE}_LIBRARY_DIR: '{prefix}/lib'
              ${PACKAGE}_VERSION: '{version}'
        projections: *unified_modules_projections
    prefix_inspections:
      '':
        - CMAKE_PREFIX_PATH
      bin:
        - PATH
      include:
        - C_INCLUDE_PATH
        - CPLUS_INCLUDE_PATH
      lib:
        - LIBRARY_PATH
        - LD_LIBRARY_PATH
      lib/pkgconfig:
        - PKG_CONFIG_PATH
      lib64:
        - LIBRARY_PATH
        - LD_LIBRARY_PATH
      lib64/pkgconfig:
        - PKG_CONFIG_PATH
      man:
        - MANPATH
      share/aclocal:
        - ACLOCAL_PATH
      share/man:
        - MANPATH
      share/pkgconfig:
        - PKG_CONFIG_PATH
#<<<
  specs:
    - matrix:
        - - $Compilers_pckgs
        - - $compilers
  view:
    Batchsystem:
      link: roots
      link_type: symlink
      projections: &unified_projections
        ^mpi: '{name}/{version}/{^mpi.name}/{^mpi.version}/{compiler.name}/{compiler.version}'
        all: '{name}/{version}/{compiler.name}/{compiler.version}'
        ~mpi: '{name}_serial/{version}/{compiler.name}/{compiler.version}'
      root: /afs/psi.ch/sys/spack-rhel7/Batchsystem
      select: *Batchsystem_pckgs
    Compilers:
      link: roots
      link_type: symlink
      projections: *unified_projections
      root: /afs/psi.ch/sys/spack-rhel7/Compilers
      select: *Compilers_pckgs
    Cuda:
      link: roots
      link_type: symlink
      projections: *unified_projections
      root: /afs/psi.ch/sys/spack-rhel7/cuda
      select: *Cuda_pckgs
    EM:
      link: roots
      link_type: symlink
      projections: *unified_projections
      root: /afs/psi.ch/sys/spack-rhel7/EM
      select: *EM_pckgs
    HDF5:
      link: roots
      link_type: symlink
      projections: *unified_projections
      root: /afs/psi.ch/sys/spack-rhel7/HDF5
      select: *HDF5_pckgs
    HDF5_serial:
      link: roots
      link_type: symlink
      projections: *unified_projections
      root: /afs/psi.ch/sys/spack-rhel7/HDF5_serial
      select: *HDF5_serial_pckgs
    Librairies:
      link: roots
      link_type: symlink
      projections: *unified_projections
      root: /afs/psi.ch/sys/spack-rhel7/Librairies
      select: *Librairies_pckgs
    MPI:
      link: roots
      link_type: symlink
      projections: *unified_projections
      root: /afs/psi.ch/sys/spack-rhel7/MPI
      select: *MPI_pckgs
    MX:
      link: roots
      link_type: symlink
      projections: *unified_projections
      root: /afs/psi.ch/sys/spack-rhel7/MX
      select: *MX_pckgs
    Programming:
      link: roots
      link_type: symlink
      projections: *unified_projections
      root: /afs/psi.ch/sys/spack-rhel7/Programming
      select: *Programming_pckgs
    System:
      link: roots
      link_type: symlink
      projections: *unified_projections
      root: /afs/psi.ch/sys/spack-rhel7/System
      select: *System_pckgs
    Tools:
      link: roots
      link_type: symlink
      projections: *unified_projections
      root: /afs/psi.ch/sys/spack-rhel7/Tools
      select: *Tools_pckgs