cleanup old spack dockerfiles

tools/docker/generate_dockerfiles.py

@@ -118,30 +118,6 @@ def main() -> None:
         with OutputFile(f"Dockerfile.test_{name}", args.check) as f:
             f.write(test_without_build(name))
 
-    with OutputFile(f"Dockerfile.gcc_spack", args.check) as f:
-        f.write(
-            spack_toolchain(
-                distro="ubuntu:22.04",
-                spec="cp2k@master%gcc build_system=cmake +enable_regtests+cosma+mpi+openmp+sirius+elpa+libxc+libint+plumed+pexsi+spglib ^openblas+fortran ^cosma+scalapack+shared ^dbcsr+mpi+shared",
-            )
-        )
-
-    with OutputFile(f"Dockerfile.gcc_spack_cuda", args.check) as f:
-        f.write(
-            spack_toolchain(
-                distro="nvidia/cuda:12.2.0-devel-ubuntu22.04",
-                spec="cp2k@master%gcc build_system=cmake +libxc+libint+sirius+elpa+plumed+pexsi+spglib+cosma+mpi+openmp+cuda cuda_arch=60  smm=libxsmm ^openblas+fortran ^cosma+scalapack+shared+cuda ^dbcsr+cuda~shared cuda_arch=60 ^sirius+cuda",
-            )
-        )
-
-    with OutputFile(f"Dockerfile.gcc_spack_rocm", args.check) as f:
-        f.write(
-            spack_toolchain(
-                distro="rocm/dev-ubuntu-22.04:5.6.1-complete",
-                spec="cp2k@master%gcc build_system=cmake +sirius +elpa +libxc +libint smm=libxsmm +spglib +cosma +rocm amdgpu_target=gfx90a +pexsi +plumed +openmp ^openblas+fortran ^dbcsr+mpi+rocm~shared+openmp amdgpu_target=gfx906 ^cosma+shared~tests~apps+rocm",
-            )
-        )
-
 
 # ======================================================================================
 def regtest(
@@ -818,77 +794,6 @@ def spack_env_toolchain() -> str:
 """
 
 
-# ======================================================================================
-def spack_toolchain(distro: str, spec: str) -> str:
-    return rf"""
-FROM {distro} as builder
-ENV DEBIAN_FRONTEND noninteractive
-
-# only the the two next lines are ubuntu specific
-RUN apt-get update -qq
-RUN apt-get install -qq --no-install-recommends autoconf autogen automake autotools-dev bzip2 ca-certificates g++ gcc gfortran git less libtool libtool-bin make nano patch pkg-config python3 unzip wget xxd zlib1g-dev cmake gnupg m4 xz-utils libssl-dev libssh-dev openmpi-common libopenmpi-dev 
-
-
-RUN wget -qO /usr/local/bin/yq https://github.com/mikefarah/yq/releases/latest/download/yq_linux_386 && chmod a+x /usr/local/bin/yq
-ENV FORCE_UNSAFE_CONFIGURE 1
-
-ENV PATH="/spack/bin:${{PATH}}"
-ENV MPICH_VERSION=4.0.3
-
-# get latest version of spack
-RUN git clone https://github.com/spack/spack.git
-
-# set the location of packages built by spack
-RUN spack config add config:install_tree:root:/opt/spack
-
-# find all external packages but exclude python
-RUN spack external find --all --exclude python
-
-# find compilers
-RUN spack compiler find
-
-# tweaking the arguments
-RUN yq -i '.compilers[0].compiler.flags.fflags = "-fallow-argument-mismatch"' /root/.spack/linux/compilers.yaml
-#RUN spack config add packages:all:target:x86_64
-# set amdgpu_target for all packages
-# RUN spack config add packages:all:variants:amdgpu_target=gfx90a
-
-# install few dependencies to help with docker caching
-RUN spack install cmake@3.27.3
-RUN spack install openblas+fortran
-RUN spack install libxsmm
-RUN spack install libxc
-RUN spack install gsl
-RUN spack install py-fypp
-RUN spack install spglib
-RUN spack install libvori
-
-ENV SPEC_OPENBLAS="{spec}"
-
-# instal all dependencies
-RUN mkdir /cp2k-src
-COPY . /cp2k-src
-
-RUN spack repo add /cp2k-src/tools/spack 
-RUN spack env create --with-view /opt/cp2k cp2k-env
-RUN spack install --only=dependencies --fail-fast $SPEC_OPENBLAS ^openmpi
-
-# copy source files of the pull request into container
-RUN spack --color always -e cp2k-env dev-build -q --source-path /cp2k-src $SPEC_OPENBLAS ^openmpi
-
-# Build CP2K with CMake and run regression tests.
-ARG TESTOPTS=""
-RUN /bin/bash -o pipefail -c " \
-    TESTOPTS='${{TESTOPTS}}' \
-    /cp2k-src/tools/docker/scripts/test_regtest_spack.sh |& tee report.log && \
-    rm -rf regtesting"
-
-# Output the report if the image is old and was therefore pulled from the build cache.
-CMD cat $(find ./report.log -mmin +10) | sed '/^Summary:/ s/$/ (cached)/'
-ENTRYPOINT []
-"""
-
-
 # ======================================================================================
 class OutputFile:
     def __init__(self, filename: str, check: bool) -> None: