TY  - RPRT
TI  - Accurate and Transferable Reactive Molecular Dynamics Models from Constrained Density Functional Theory
AU  - Li, Chenghan
AU  - Voth, Gregory A.
PY  - 2021
DO  - 10.1021/acs.jpcb.1c05992
UR  - https://www.osti.gov/biblio/1819982
ID  - 1819982
ER  -