Role of an ethyl radical and the problem of HF(v) bimodal vibrational distribution in the F(2P) + C2H6 → HF(v) + C2H5 reaction

Phys. Chem. Chem. Phys., 2018, Advance Article DOI: 10.1039/C8CP05242E, PaperJ. Espinosa-Garcia, M. Garcia-Chamorro A theoretical study of the dynamics of the F(2P) + C2H6 hydrogen abstraction reaction was presented using quasi-classical trajectories propagated on anab initio fitted global potential energy surface, PES-2018. To cite this article before page numbers are assigned, use the DOI form of citation above. The content of this RSS Feed (c) The Royal Society of Chemistry

Source: RSC - Phys. Chem. Chem. Phys. latest articles - October 15, 2018 Category: Chemistry Authors: J. Espinosa-Garcia Source Type: research