Direct Grid-Based Nonadiabatic Dynamics on Machine-Learned Potential Energy Surfaces: Application to Spin-Forbidden Processes. (2020)
Attributed to:
Rational design of photoactive molecules using "black box" quantum dynamics simulations
funded by
EPSRC
Abstract
No abstract provided
Bibliographic Information
Digital Object Identifier: http://dx.doi.org/10.1021/acs.jpca.0c06125
PubMed Identifier: 33104337
Publication URI: http://europepmc.org/abstract/MED/33104337
Type: Journal Article/Review
Volume: 124
Parent Publication: The journal of physical chemistry. A
Issue: 44
ISSN: 1089-5639