@misc{indiciaed6b2aa4ed58c, title = {TeraChem: A graphical processing unit-accelerated electronic structure package for large-scale ab initio molecular dynamics}, author = {Seritan, Stefan and Bannwarth, Christoph and Fales, Bryan S. and Hohenstein, Edward G. and Isborn, Christine M. and Kokkila‐Schumacher, Sara L. and Li, Xin and Liu, Fang and Luehr, Nathan and Snyder, James W. and Song, Chenchen and Titov, Alexey V. and Ufimtsev, Ivan S. and Wang, Lee‐Ping and Martínez, Todd J.}, year = {2020}, doi = {10.1002/wcms.1494}, url = {https://www.osti.gov/biblio/1656582}, note = {Source identifier: 1656582} }