The influence of spin–orbit coupling, Duschinsky rotation and displacement vector on the rate of intersystem crossing of benzophenone and its fused analog fluorenone: a time dependent correlation function based approach
Author:
Affiliation:
1. Department of Chemistry
2. University of Calcutta
3. Kolkata – 700009
4. India
Abstract
A time dependent correlation function based study reveals that the rate of intersystem crossing of benzophenone and its fused analog, fluorenone is governed by a complex combination of spin–orbit coupling, displacements and Duschinsky mode mixing.
Funder
Council of Scientific and Industrial Research, India
Publisher
Royal Society of Chemistry (RSC)
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://pubs.rsc.org/en/content/articlepdf/2020/CP/D0CP04713A
Reference65 articles.
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