@misc{indiciaeb1e622d7f0ed, title = {Semi-Empirical Shadow Molecular Dynamics: A PyTorch Implementation}, author = {Kulichenko, Maksim and Barros, Kipton Marcos and Lubbers, Nicholas Edward and Fedik, Nikita and Zhou, Guoqing and Tretiak, Sergei and Nebgen, Benjamin Tyler and Niklasson, Anders N.}, year = {2023}, doi = {10.1021/acs.jctc.3c00234}, url = {https://www.osti.gov/biblio/1985863}, note = {Source identifier: 1985863} }