@misc{indiciae8e9f19b69044, title = {Permutationally Restrained Diabatization by Machine Intelligence}, author = {Shu, Yinan and Varga, Zoltan (ORCID:000000029324798X) and Sampaio de Oliveira-Filho, Antonio Gustavo and Truhlar, Donald G. (ORCID:0000000277427294)}, year = {2021}, doi = {10.1021/acs.jctc.0c01110}, url = {https://www.osti.gov/biblio/1852049}, note = {Source identifier: 1852049} }