Build/test/release with a container action

.github/Dockerfile/base-catch2.Dockerfile

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+# Copyright 2023 NWChemEx-Project
+#
+# Licensed under the Apache License, Version 2.0 (the "License");
+# you may not use this file except in compliance with the License.
+# You may obtain a copy of the License at
+#
+# http://www.apache.org/licenses/LICENSE-2.0
+#
+# Unless required by applicable law or agreed to in writing, software
+# distributed under the License is distributed on an "AS IS" BASIS,
+# WITHOUT WARRANTIES OR CONDITIONS OF ANY KIND, either express or implied.
+# See the License for the specific language governing permissions and
+# limitations under the License.
+
+ARG PARENT_IMAGE_NAME
+
+FROM ${PARENT_IMAGE_NAME}:latest
+
+ARG CATCH2_VERSION
+
+# Install catch2 ##
+RUN cd /tmp \
+    && git clone -b v${CATCH2_VERSION} https://github.com/catchorg/Catch2.git \
+    && cd Catch2 \
+    && cmake -Bbuild -H. -DBUILD_TESTING=OFF -DCMAKE_INSTALL_PREFIX=/install \
+    && cmake --build build \
+    && cmake --build build --target install \
+    && rm -rf /tmp/Catch2

.github/Dockerfile/base-cereal.Dockerfile

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+# Copyright 2023 NWChemEx-Project
+#
+# Licensed under the Apache License, Version 2.0 (the "License");
+# you may not use this file except in compliance with the License.
+# You may obtain a copy of the License at
+#
+# http://www.apache.org/licenses/LICENSE-2.0
+#
+# Unless required by applicable law or agreed to in writing, software
+# distributed under the License is distributed on an "AS IS" BASIS,
+# WITHOUT WARRANTIES OR CONDITIONS OF ANY KIND, either express or implied.
+# See the License for the specific language governing permissions and
+# limitations under the License.
+
+ARG PARENT_IMAGE_NAME
+
+FROM ${PARENT_IMAGE_NAME}:latest
+
+ARG CEREAL_VERSION
+
+# Install cereal
+RUN cd /tmp \
+    && git clone https://github.com/USCiLab/cereal.git \
+    && cd cereal \
+    && git checkout tags/v${CEREAL_VERSION} \
+    && export BUILD_TARGET=cereal \
+    && export FIND_TARGET=cereal \
+    && cmake -DJUST_INSTALL_CEREAL=ON -DCMAKE_INSTALL_PREFIX=/install -Bbuild . \
+    && cmake --build build \
+    && cmake --build build --target install \
+    && rm -rf /tmp/cereal

.github/Dockerfile/base-madness.Dockerfile

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+# Copyright 2023 NWChemEx-Project
+#
+# Licensed under the Apache License, Version 2.0 (the "License");
+# you may not use this file except in compliance with the License.
+# You may obtain a copy of the License at
+#
+# http://www.apache.org/licenses/LICENSE-2.0
+#
+# Unless required by applicable law or agreed to in writing, software
+# distributed under the License is distributed on an "AS IS" BASIS,
+# WITHOUT WARRANTIES OR CONDITIONS OF ANY KIND, either express or implied.
+# See the License for the specific language governing permissions and
+# limitations under the License.
+
+ARG PARENT_IMAGE_NAME
+
+FROM ${PARENT_IMAGE_NAME}:latest
+
+# Install mpi
+RUN    apt-get update \
+        && DEBIAN_FRONTEND=noninteractive apt-get install -y \
+                openmpi-bin \
+                libopenmpi-dev 
+ARG MADNESS_VERSION
+
+# Install MADNESS
+RUN cd /tmp \
+    && git clone https://github.com/m-a-d-n-e-s-s/madness.git \
+    && cd madness \
+    && git checkout ${MADNESS_VERSION} \
+    && export BUILD_TARGET=MADworld \
+    && export FIND_TARGET=MADworld \
+    && cmake -DENABLE_UNITTESTS=OFF -DMADNESS_BUILD_MADWORLD_ONLY=ON -DMADNESS_ENABLE_CEREAL=ON -DENABLE_MKL=OFF -DENABLE_ACML=OFF -DBUILD_TESTING=OFF -DCMAKE_INSTALL_PREFIX=/install -Bbuild . \
+    && cmake --build build \
+    && cmake --build build --target install \
+    && rm -rf /tmp/madness

.github/Dockerfile/base-spdlog.Dockerfile

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+# Copyright 2023 NWChemEx-Project
+#
+# Licensed under the Apache License, Version 2.0 (the "License");
+# you may not use this file except in compliance with the License.
+# You may obtain a copy of the License at
+#
+# http://www.apache.org/licenses/LICENSE-2.0
+#
+# Unless required by applicable law or agreed to in writing, software
+# distributed under the License is distributed on an "AS IS" BASIS,
+# WITHOUT WARRANTIES OR CONDITIONS OF ANY KIND, either express or implied.
+# See the License for the specific language governing permissions and
+# limitations under the License.
+
+ARG PARENT_IMAGE_NAME
+
+FROM ${PARENT_IMAGE_NAME}:latest
+
+ARG SPDLOG_VERSION
+
+# Install spdlog
+RUN cd /tmp \
+    && git clone https://github.com/gabime/spdlog.git \
+    && cd spdlog \
+    && git checkout ${SPDLOG_VERSION} \
+    && export BUILD_TARGET=spdlog \
+    && export FIND_TARGET=spdlog::spdlog \
+    && cmake -DSPDLOG_INSTALL=ON -DCMAKE_INSTALL_PREFIX=/install -DCMAKE_CXX_FLAGS="-fPIC" -Bbuild . \
+    && cmake --build build \
+    && cmake --build build --target install \
+    && rm -rf /tmp/spdlog

.github/Dockerfile/build_tmp.Dockerfile.old

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+ARG btag
+
+###
+
+FROM ghcr.io/nwchemex-ci-test/base_parallelzone:$btag

.github/Dockerfile/release.Dockerfile.old

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+FROM ubuntu:20.04
+ADD install /install

.github/actions/container-build_test_release/Dockerfile

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+# Copyright 2023 NWChemEx-Project
+#
+# Licensed under the Apache License, Version 2.0 (the "License");
+# you may not use this file except in compliance with the License.
+# You may obtain a copy of the License at
+#
+# http://www.apache.org/licenses/LICENSE-2.0
+#
+# Unless required by applicable law or agreed to in writing, software
+# distributed under the License is distributed on an "AS IS" BASIS,
+# WITHOUT WARRANTIES OR CONDITIONS OF ANY KIND, either express or implied.
+# See the License for the specific language governing permissions and
+# limitations under the License.
+
+FROM alpine:latest
+
+COPY docker-action /docker-action
+COPY entrypoint.sh /entrypoint.sh
+
+RUN apk add --update --no-cache docker
+RUN ["chmod", "+x", "/entrypoint.sh"]
+
+# Code file to execute when the docker container starts up (`entrypoint.sh`)
+ENTRYPOINT ["/entrypoint.sh"]

.github/actions/container-build_test_release/action.yaml

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+# Copyright 2023 NWChemEx-Project
+#
+# Licensed under the Apache License, Version 2.0 (the "License");
+# you may not use this file except in compliance with the License.
+# You may obtain a copy of the License at
+#
+# http://www.apache.org/licenses/LICENSE-2.0
+#
+# Unless required by applicable law or agreed to in writing, software
+# distributed under the License is distributed on an "AS IS" BASIS,
+# WITHOUT WARRANTIES OR CONDITIONS OF ANY KIND, either express or implied.
+# See the License for the specific language governing permissions and
+# limitations under the License.
+
+name: container action to build ParallelZone
+
+description: container action from the base image to build ParallelZone
+
+inputs:
+  base_tag:
+    description: 'tag of the base image'
+    required: false
+    default: 'stable'
+  token:
+    type: string
+    required: true
+  user:
+    type: string
+    required: true
+  cmake_version:
+    type: string
+    required: false
+    default: ''
+  gcc_version:
+    type: string
+    required: false
+    default: ''
+  clang_version:
+    type: string
+    required: false
+    default: ''
+  ninja_build:
+    type: boolean
+    required: true
+  use_clang:
+    type: boolean
+    required: true
+  CMAIZE_GITHUB_TOKEN:
+    type: string
+    required: true
+  INSTALL:
+    type: boolean
+    required: true
+  test:
+    type: boolean
+    required: true
+  integration_test:
+    type: boolean
+    required: true
+  branch_name:
+    type: string
+    required: true
+runs:
+  using: 'docker'
+  image: 'Dockerfile'
+  args:
+    - ${{ inputs.token }} # 1
+    - ${{ inputs.user }}  # 2
+    - ${{ inputs.base_tag }}  # 3
+    - ${{ inputs.cmake_version }} # 4
+    - ${{ inputs.gcc_version }} # 5
+    - ${{ inputs.clang_version }} # 6
+    - ${{ inputs.ninja_build }} # 7
+    - ${{ inputs.use_clang }} # 8
+    - ${{ inputs.CMAIZE_GITHUB_TOKEN }} # 9
+    - ${{ inputs.INSTALL }} # 10
+    - ${{ inputs.test }} # 11
+    - ${{ inputs.integration_test }} # 12
+    - ${{ inputs.branch_name }} # 13

.github/actions/container-build_test_release/docker-action/Dockerfile

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+# Copyright 2023 NWChemEx-Project
+#
+# Licensed under the Apache License, Version 2.0 (the "License");
+# you may not use this file except in compliance with the License.
+# You may obtain a copy of the License at
+#
+# http://www.apache.org/licenses/LICENSE-2.0
+#
+# Unless required by applicable law or agreed to in writing, software
+# distributed under the License is distributed on an "AS IS" BASIS,
+# WITHOUT WARRANTIES OR CONDITIONS OF ANY KIND, either express or implied.
+# See the License for the specific language governing permissions and
+# limitations under the License.
+
+ARG base_tag
+
+FROM ghcr.io/nwchemex-project/base_parallelzone:$base_tag
+
+COPY build_test.sh /build_test.sh
+
+RUN ["chmod", "+x", "/build_test.sh"]
+
+ARG cmake_version
+ARG gcc_version
+ARG clang_version
+ARG ninja_build
+ARG use_clang
+ARG cmaize_github_token
+ARG install
+ARG unit_test
+ARG int_test
+ARG branch_name
+
+ENV env_cmake_version=$cmake_version
+ENV env_gcc_version=$gcc_version
+ENV env_clang_version=$clang_version
+ENV env_ninja_build=$ninja_build
+ENV env_use_clang=$use_clang
+ENV env_cmaize_github_token=$cmaize_github_token
+ENV env_install=$install
+ENV env_unit_test=$unit_test
+ENV env_int_test=$int_test
+ENV env_branch_name=$branch_name
+
+ENTRYPOINT ["/build_test.sh"]