materialsproject/jupyter-singleuser-workshop repository overview

⁠Materials Project Workshop

Assets for the Materials Project workshop.

This repository is under development for our August 2019 workshop. There may be changes up until the day(s) of the workshop. Click here⁠ for a snapshot of the 2018 workshop assets.

⁠Tests

The following will check that all notebooks run properly.

python setup.py install
pip install -r requirements.txt
python test.py

If you get an error like

then that notebook expects to be run using an IPython kernel with that name. With your Python environment activated, run

python -m ipykernel install --user --name <ENVNAME>

where <ENVNAME> is the name in the error message, e.g. conda-env-mp-py. This will ensure that the notebook uses your local environment. to run itself.

⁠Docker

Docker build for Jupyter Singleuser container to be used in MP Workshop