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A new diabatization scheme for direct quantum dynamics: Procrustes diabatization. (2020)

First Author: Richings GW

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/10.1063/5.0003254

PubMed Identifier: 32321267

Publication URI: http://europepmc.org/abstract/MED/32321267

Type: Journal Article/Review

Volume: 152

Parent Publication: The Journal of chemical physics

Issue: 15

ISSN: 0021-9606