TY - RPRT TI - Accurate and scalable graph neural network force field and molecular dynamics with direct force architecture AU - Park, Cheol Woo AU - Kornbluth, Mordechai (ORCID:0000000167058133) AU - Vandermause, Jonathan (ORCID:0000000155593147) AU - Wolverton, Chris (ORCID:000000032248474X) AU - Kozinsky, Boris (ORCID:000000020638539X) AU - Mailoa, Jonathan P. (ORCID:0000000322396192) PY - 2021 DO - 10.1038/s41524-021-00543-3 UR - https://www.osti.gov/biblio/1848250 ID - 1848250 ER -