Update HSE examples, reduce the testing time, modify some outputs for HSE and LR calculations, reformat the output atomic positions, change 'jd' files in integreate tests to 'README' files #11536
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| name: Build Test | |
| on: | |
| push: | |
| pull_request: | |
| jobs: | |
| test: | |
| runs-on: ubuntu-latest | |
| strategy: | |
| matrix: | |
| include: | |
| - tag: intel | |
| build_args: "CXX=mpiicpc ELPA_LIB_DIR=/usr/local/lib ELPA_INCLUDE_DIR=/usr/local/include CEREAL_DIR=/usr/include/cereal OPENMP=ON" | |
| name: "Build with Makefile & Intel compilers" | |
| name: ${{ matrix.name }} | |
| container: ghcr.io/deepmodeling/abacus-${{ matrix.tag }} | |
| steps: | |
| - name: Checkout | |
| uses: actions/checkout@v4 | |
| - name: Build | |
| run: | | |
| export I_MPI_CXX=icpx | |
| cd source | |
| make -j2 ${{ matrix.build_args }} | |