Direct Nonadiabatic Dynamics by Mixed Quantum-Classical Formalism Connected with Ensemble Density Functional Theory Method: Application to trans-Penta-2,4-dieniminium Cation

Title
Direct Nonadiabatic Dynamics by Mixed Quantum-Classical Formalism Connected with Ensemble Density Functional Theory Method: Application to trans-Penta-2,4-dieniminium Cation
Authors
Keywords
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Journal
Journal of Chemical Theory and Computation
Volume 14, Issue 9, Pages 4499-4512
Publisher
American Chemical Society (ACS)
Online
2018-07-28
DOI
10.1021/acs.jctc.8b00217

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