New Analytical Potential Energy Surface for the F(2P) + CH4 Hydrogen Abstraction Reaction: Kinetics and Dynamics
Author:
Affiliation:
1. Departamento de Química Física, Universidad de Extremadura, 06071 Badajoz, Spain
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/jp0688759
Reference68 articles.
1. Theoretical study of the CH4+F→CH3+FH reaction. I. Ab initio reaction path
2. Potential Energy Surface for the F(2P3/2,2P1/2) + CH4 Hydrogen Abstraction Reaction. Kinetics and Dynamics Study
3. Quasiclassical Trajectory Study of the F + CH4 Reaction Dynamics on a Dual-Level Interpolated Potential Energy Surface
4. Ab initioand direct quasiclassical-trajectory study of the F+CH4→HF+CH3 reaction
5. Ab initiopotential energy surface, variational transition state theory, and quasiclassical trajectory studies of the F+CH4→HF+CH3 reaction
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