Merge pull request #497 from ilfreddy/surface_forces #780
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| name: Build and test MRChem | |
| on: | |
| push: | |
| branches: | |
| - master | |
| - release/* | |
| pull_request: | |
| branches: | |
| - master | |
| - release/* | |
| release: | |
| types: | |
| - created | |
| env: | |
| BUILD_TYPE: Release | |
| jobs: | |
| build: | |
| runs-on: ${{ matrix.os }} | |
| strategy: | |
| matrix: | |
| # setup-miniconda not compatible with macos-latest presently. | |
| # https://github.com/conda-incubator/setup-miniconda/issues/344 | |
| os: [ubuntu-latest, macos-12] | |
| steps: | |
| - uses: actions/checkout@v2 | |
| - name: Cache conda | |
| uses: actions/cache@v1 | |
| env: | |
| CACHE_NUMBER: 0 # Increase this value to reset cache if .github/mrchem-gha.yml has not changed | |
| with: | |
| path: ~/conda_pkgs_dir | |
| key: | |
| ${{ matrix.os }}-conda-${{ env.CACHE_NUMBER }}-${{ hashFiles('.github/mrchem-gha.yml') }} | |
| - uses: conda-incubator/setup-miniconda@v3 | |
| with: | |
| auto-update-conda: true | |
| auto-activate-base: false | |
| activate-environment: mrchem-gha | |
| environment-file: .github/mrchem-gha.yml | |
| channel-priority: true | |
| python-version: 3.9 | |
| use-only-tar-bz2: true # IMPORTANT: This needs to be set for caching to work properly! | |
| - name: Configure | |
| shell: bash -l {0} | |
| run: | | |
| python ./setup --type=$BUILD_TYPE --omp --arch-flags=false --generator=Ninja --prefix=$GITHUB_WORKSPACE/Software/MRChem build | |
| - name: Build | |
| shell: bash -l {0} | |
| run: | | |
| cmake --build build --config $BUILD_TYPE --target install -- -v -d stats | |
| - name: Test | |
| shell: bash -l {0} | |
| run: | | |
| cd build | |
| ctest -C $BUILD_TYPE --output-on-failure --verbose |