I'm doing material informatics on my bachelor thesis, here is some code that I write related to VASP mostly, including parser for VASP output file, and machine learning analysis on jupyter notebooks.
Create a virtual environment and install required dependencies using $ pip install -r requirements.txt
and you're good to go.
Run $ python parser/cmd.py <structure name>
on structure directory that contains OUTCAR from VASP calculation.
You'll have atom positions, magnetic moments, energies, and number of electrons on DATA
file.
Licensed under The MIT License.