update lo, add geomopt #318
This file contains bidirectional Unicode text that may be interpreted or compiled differently than what appears below. To review, open the file in an editor that reveals hidden Unicode characters.
Learn more about bidirectional Unicode characters
| name: CI | |
| on: [push, pull_request] | |
| jobs: | |
| build: | |
| runs-on: ${{ matrix.os }} | |
| strategy: | |
| matrix: | |
| os: [ubuntu-20.04] | |
| python-version: ["3.8", "3.9", "3.10", "3.11"] | |
| environment: ci | |
| steps: | |
| - uses: actions/checkout@v2 | |
| - name: Set up Python ${{ matrix.python-version }} | |
| uses: actions/setup-python@v2 | |
| with: | |
| python-version: ${{ matrix.python-version }} | |
| - name: install pyscf | |
| run: ./.github/workflows/install_pyscf.sh | |
| - name: install pyscfadlib | |
| run: ./.github/workflows/install_pyscfadlib.sh | |
| - name: test | |
| run: ./.github/workflows/run_test.sh | |
| - name: Upload coverage to codecov | |
| uses: codecov/codecov-action@v3 | |
| with: | |
| token: ${{secrets.CODECOV_TOKEN}} | |
| files: ./pyscfad/coverage.xml |