#
# This file was created by generate_dockerfiles.py.
# Usage: ./spack_cache_start.sh; podman build --shm-size=1g -t spack_ssmp-static -f ./Dockerfile.test_spack_ssmp-static ../../
#

ARG BASE_IMAGE="ubuntu:26.04"

###### Stage 1: Build CP2K dependencies ######

FROM "${BASE_IMAGE}" AS build_deps

RUN apt-get update -qq && apt-get install -qq --no-install-recommends \
    bzip2 \
    ca-certificates \
    cmake \
    g++ gcc gfortran \
    git \
    gnupg \
    libssh-dev \
    libssl-dev \
    libtool \
    libtool-bin \
    lsb-release \
    make \
    patch \
    pkgconf \
    python3 \
    python3-dev \
    python3-pip \
    python3-venv \
    unzip \
    wget \
    xxd \
    xz-utils \
    zlib1g \
    zlib1g-dev \
    zstd \
    && rm -rf /var/lib/apt/lists/*

ARG IMAGE_TAG
ENV IMAGE_TAG=${IMAGE_TAG:-spack_ssmp-static}

ARG SPACK_CACHE
ENV SPACK_CACHE="${SPACK_CACHE:-s3://spack-cache --s3-endpoint-url=http://host.containers.internal:9000}"

# Build CP2K dependencies
WORKDIR /opt/cp2k
COPY ./tools/spack ./tools/spack
COPY ./tools/docker ./tools/docker
COPY ./make_cp2k.sh .
RUN ./make_cp2k.sh -bd_only -cv ssmp-static -gpu none  -mpi no  

###### Stage 2: Build CP2K ######

FROM build_deps AS build_cp2k

COPY ./src ./src
COPY ./data ./data
COPY ./tools/build_utils ./tools/build_utils
COPY ./cmake ./cmake
COPY ./CMakeLists.txt .

RUN ./make_cp2k.sh -cv ssmp-static  -gpu none -mpi no 

###### Stage 3: Install CP2K ######

FROM "${BASE_IMAGE}" AS install_cp2k

RUN apt-get update -qq && apt-get install -qq --no-install-recommends \
    g++ gcc gfortran \
    python3 \
    && rm -rf /var/lib/apt/lists/*

WORKDIR /opt/cp2k

# Install CP2K dependencies built with spack
COPY --from=build_cp2k /opt/cp2k/spack/spack/opt/spack ./spack/spack/opt/spack

# Install CP2K
COPY --from=build_cp2k /opt/cp2k/install ./install

# Install CP2K regression tests
COPY ./tests ./tests
COPY --from=build_cp2k /opt/cp2k/src/grid/sample_tasks ./src/grid/sample_tasks

# Install CP2K/Quickstep CI benchmarks
COPY ./benchmarks/CI ./benchmarks/CI

# Do not rely only on LD_LIBRARY_PATH because it is fragile
COPY --from=build_cp2k /etc/ld.so.conf.d/cp2k.conf /etc/ld.so.conf.d/cp2k.conf
RUN ldconfig

# Run CP2K regression test
RUN /opt/cp2k/install/bin/launch /opt/cp2k/install/bin/run_tests --keepalive || echo "ERROR: Tests failed"

# Create entrypoint and finalise container build
WORKDIR /mnt
ENTRYPOINT ["/opt/cp2k/install/bin/launch"]
CMD ["cp2k", "--help", "--version"]