Move ERI computation to the IPU, keeping sparse symmetric einsum functionality #229
Workflow file for this run
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: pytest notebooks | |
on: | |
pull_request: | |
push: | |
branches: [main] | |
jobs: | |
pytest-container: | |
runs-on: ubuntu-latest | |
container: | |
image: graphcore/pytorch:3.2.0-ubuntu-20.04 | |
steps: | |
- uses: actions/checkout@v3 | |
- name : Install package dependencies | |
run: | | |
apt update -y | |
apt install git -y | |
- name: Install requirements | |
run: | | |
pip install -U pip | |
pip install -e ".[test,ipu]" | |
- name: Log installed environment | |
run: | | |
python3 -m pip freeze | |
- name: Test nanoDFT demo notebook | |
env: | |
JAX_IPU_USE_MODEL: 1 | |
JAX_IPU_MODEL_NUM_TILES: 46 | |
run: | | |
pytest --nbmake --nbmake-timeout=3000 notebooks/nanoDFT-demo.ipynb |