An accurate potential energy surface for the F + H2 → HF + H reaction by the coupled-cluster method
Author:
Affiliation:
1. State Key Laboratory of Molecular Reaction Dynamics and Center for Theoretical Computational Chemistry, Dalian Institute of Chemical Physics, Chinese Academy of Sciences, Dalian 116023, People’s Republic of China
Funder
National Basic Research Program of China
National Natural Science Foundation of China (NSFC)
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://aip.scitation.org/doi/pdf/10.1063/1.4904546
Reference71 articles.
1. The H+H2reactive system. Progress in the study of the dynamics of the simplest reaction
2. An improved H3 potential energy surface
3. A refined H3 potential energy surface
4. Forward scattering due to slow-down of the intermediate in the H + HD → D + H2 reaction
5. Resonance-Mediated Chemical Reaction:F+HD→HF+D
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