testing.yml

name: Testing

on: [push, pull_request]

jobs:
  build:

    strategy:
      matrix:
        os: [ubuntu-latest]
        python-version: ['3.9']

    runs-on: ${{ matrix.os }}

    env:
      PMG_MAPI_KEY: ${{ secrets.PMG_MAPI_KEY }}
      MPLBACKEND: "Agg"

    steps:
    - uses: actions/checkout@v3
    - name: Set up Python ${{ matrix.python-version }}
      uses: actions/setup-python@v4
      with:
        python-version: ${{ matrix.python-version }}
        cache: pip
        cache-dependency-path: setup.py
    - name: Install dependencies
      run: |
        python -m pip install --upgrade pip
        pip install --quiet -r requirements.txt -r requirements-ci.txt
        pip install -e .
    - name: pytest
      run: |
        pytest --cov=pymatgen.analysis.diffusion --durations=30 pymatgen
    - name: Upload coverage reports to Codecov
      uses: codecov/codecov-action@v3
      env:
        CODECOV_TOKEN: ${{ secrets.CODECOV_TOKEN }}