Publication - Journal Article PyCDT: A Python toolkit for modeling point defects in semiconductors and insulators

https://doi.org/10.1016/j.cpc.2018.01.004
Journal Article
Computer Physics Communications, vol. 226, pp. 165-179, 2018
Authors
Danny Broberg, Bharat Medasani, Nils E.R. Zimmermann, Guodong Yu, Andrew Canning, Maciej Harańczyk, Mark Asta, Geoffroy Hautier
English