Evaluation of the Time-Derivative Coupling for Accurate Electronic State Transition Probabilities from Numerical Simulations
Author:
Affiliation:
1. Department of Chemistry, Michigan State University, East Lansing, Michigan 48824, United States
Publisher
American Chemical Society (ACS)
Subject
General Materials Science,Physical and Theoretical Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/jz5009449
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1. Trajectory Surface Hopping Approach to Nonadiabatic Molecular Collisions: The Reaction of H+ with D2
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5. Methods for molecular dynamics with nonadiabatic transitions
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