@misc{indiciae2f2747d1b805, title = {PyCDT: A Python toolkit for modeling point defects in semiconductors and insulators}, author = {Broberg, Danny and Medasani, Bharat and Zimmermann, Nils E. R. and Yu, Guodong and Canning, Andrew and Haranczyk, Maciej and Asta, Mark and Hautier, Geoffroy}, year = {2018}, doi = {10.1016/j.cpc.2018.01.004}, url = {https://www.osti.gov/biblio/1634156}, note = {Source identifier: 1634156} }