The CH(X2Π) + H2O reaction: two transition state kinetics
Author:
Affiliation:
1. Quantum Theory Project
2. Department of Chemistry and Physics
3. University of Florida
4. Gainesville
5. USA
6. Department of Chemistry
7. University of Leuven
8. B-3001 Heverlee
9. Belgium
Abstract
Reaction rate coefficients are calculated using the SCTST/2DME approach based on a high accuracy PES obtained with HEAT protocol.
Funder
U.S. Department of Energy
Publisher
Royal Society of Chemistry (RSC)
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://pubs.rsc.org/en/content/articlepdf/2021/CP/D1CP02234B
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