Fixed Screened potential so that we can use any core level rather #11
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| name: Check Compilers | |
| on: [push, pull_request] | |
| jobs: | |
| # Partially kanged from https://github.com/raberanto-lmd/COSPv2.0/blob/Test/.github/workflows/continuous_integration.yml | |
| test_intel: | |
| runs-on: ubuntu-20.04 | |
| strategy: | |
| matrix: | |
| fortran-compiler: [ifort] | |
| env: | |
| F90: ${{ matrix.fortran-compiler }} | |
| FC: ${{ matrix.fortran-compiler }} | |
| steps: | |
| - uses: actions/checkout@v2 | |
| - name: Install C-Shell | |
| run: | | |
| sudo apt-get install csh xutils-dev libncurses-dev | |
| wget https://astron.com/pub/tcsh/old/tcsh-6.22.04.tar.gz | |
| gunzip < tcsh-6.22.04.tar.gz | tar xof - | |
| cd tcsh-6.22.04 | |
| ./configure --prefix="" | |
| make -j16 | |
| sudo make install | |
| # https://software.intel.com/content/www/us/en/develop/articles/installing-intel-oneapi-toolkits-via-apt.html | |
| # Packages from Docker file at | |
| # https://github.com/intel/oneapi-containers/blob/master/images/docker/hpckit-devel-ubuntu18.04/Dockerfile | |
| - name: Install Intel compilers and libraries | |
| if: contains(matrix.fortran-compiler, 'ifort') && steps.cache-intel-compilers.outputs.cache-hit != 'true' | |
| run: | | |
| wget https://apt.repos.intel.com/intel-gpg-keys/GPG-PUB-KEY-INTEL-SW-PRODUCTS-2023.PUB | |
| sudo apt-key add GPG-PUB-KEY-INTEL-SW-PRODUCTS-2023.PUB | |
| sudo add-apt-repository "deb https://apt.repos.intel.com/oneapi all main" | |
| sudo apt-get update | |
| sudo apt-get install intel-hpckit-getting-started intel-oneapi-clck intel-oneapi-common-licensing intel-oneapi-common-vars | |
| sudo apt-get install intel-oneapi-dev-utilities intel-oneapi-compiler-dpcpp-cpp-and-cpp-classic intel-oneapi-compiler-fortran intel-oneapi-itac | |
| - name: Environment for ifort compiler | |
| if: contains(matrix.fortran-compiler, 'ifort') | |
| run: | | |
| echo "CC=icx" > $GITHUB_ENV | |
| echo "FC=ifort" > $GITHUB_ENV | |
| echo "F90FLAGS=-O3 -heap-arrays" > $GITHUB_ENV | |
| - name: Build | |
| run: | | |
| source /opt/intel/oneapi/setvars.sh || true | |
| cd src && make | |
| - name: Test | |
| run: | | |
| echo "$GITHUB_WORKSPACE/bin" >> $GITHUB_PATH | |
| source /opt/intel/oneapi/setvars.sh || true | |
| cd examples | |
| ./runtests.csh | |
| # TODO: Modify Makefiles and enable | |
| # test_gfortran: | |
| # runs-on: ubuntu-20.04 | |
| # strategy: | |
| # matrix: | |
| # fortran-compiler: [gfortran, gfortran-8, gfortran-7] | |
| # # gfortran-10 is broken for now, see https://github.com/times-software/feff10/issues/4 | |
| # env: | |
| # F90: ${{ matrix.fortran-compiler }} | |
| # FC: ${{ matrix.fortran-compiler }} | |
| # # Sequence of tasks that will be executed as part of the job | |
| # steps: | |
| # # Checks-out repository under $GITHUB_WORKSPACE | |
| # - uses: actions/checkout@v2 | |
| # - name: Install gfortran compiler | |
| # if: contains(matrix.fortran-compiler, 'gfortran') | |
| # run: sudo apt-get install ${{ matrix.fortran-compiler }} |