Correcting Rate Constants from Anharmonic Molecular Dynamics for Quantum Effects

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Authors: Felix Schmalz, Wassja A. Kopp, Leif C. Kröger, Kai Leonhard

Journal title: ACS Omega

Journal number: 5/5

Journal publisher: American Chemical Society

Published year: 2020

Published pages: 2242-2253

DOI identifier: 10.1021/acsomega.9b03383

ISSN: 2470-1343