Overcoming positivity violations for density matrices in surface hopping
Author:
Affiliation:
1. Department of Chemistry, Northwestern University , 2145 Sheridan Road, Evanston, Illinois 60208, USA
Abstract
Funder
National Science Foundation
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
https://pubs.aip.org/aip/jcp/article-pdf/doi/10.1063/5.0135456/16703414/054117_1_online.pdf
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5. Memory effects in the relaxation of quantum open systems;J. Chem. Phys.,1992
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