Variational Density Functional Calculations of Excited States: Conical Intersection and Avoided Crossing in Ethylene Bond Twisting
Author:
Affiliation:
1. Science Institute of the University of Iceland, VR-III, 107 Reykjavík, Iceland
2. Faculty of Physical Sciences, University of Iceland, VR-III, 107 Reykjavík, Iceland
3. Department of Applied Physics, Aalto University, FI-00076 Espoo, Finland
Funder
Icelandic Centre for Research
Publisher
American Chemical Society (ACS)
Subject
General Materials Science,Physical and Theoretical Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/acs.jpclett.2c00741
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