Lucy Whalley

Hi @MariaEstRo, I think `bk=[x,y]` where `x` is an integer number corresponding to the band index and `y` is an integer number corresponding to the kpoint index should work. kpoints...

Just to add a note on this. This could be automatically deployed once a version tag is created on the main repo branch, similar to the workflow implemented ThermoPot (https://github.com/NU-CEM/ThermoPot/blob/main/.github/workflows/build-n-publish.yml).

After some recent PR's I should also: - update API documentation for Datavasprun - Update Jupyter notebook example of reading in vasprun.xml

The documentation site is looking pretty tired in general. It would be nice to migrate this to mkdocs and mkdocstrings (for automatic documentation from docstrings a la sphinx).

@editorialbot assign me as editor

@kyleniemeyer - it's a little outside, but will manage! :)

@ebezzam @dhimmel @klb2 - hello 👋 - are you available to review this submission to JOSS?

Great @klb2 👍 @dhimmel - thanks for your response, hope to work with you on another review sometime 🖊️

@editorialbot add @klb2 as reviewer

@taladjidi @amritagos @ebezzam - hello 👋 - are you available to review this submission to JOSS?