Semiclassical Nonadiabatic Molecular Dynamics Using Linearized Pair-Density Functional Theory
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Full Citation
M. R. Hennefarth, D. G. Truhlar, and L. Gagliardi, Semiclassical Nonadiabatic Molecular Dynamics Using Linearized Pair-Density Functional Theory, J. Chem. Theory Comput., 2024. DOI: 10.1021/acs.jctc.4c01061