Elucidation of the O(1D) + HF → F + OH mechanism by means of quasiclassical trajectories

The dynamics and mechanism of the O( 1 D) + HF → F + OH reaction have been studied through quasi-classical trajectory calculations carried out on the 1 1 A′ Potential Energy Surface (PES) fitted by Gómez-Carrasco et al. [ Chem. Phys. Lett. , 2007, 435 , 188]. The influence of the collision energy an...

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Veröffentlicht in:	Physical chemistry chemical physics : PCCP 2012-12, Vol.14 (47), p.16338-16348
Hauptverfasser:	Jambrina, P. G, Montero, I, Aoiz, F. J, Aldegunde, J, Alvariño, J. M
Format:	Artikel
Sprache:	eng
Schlagworte:	Chemistry Exact sciences and technology General and physical chemistry
Online-Zugang:	Volltext
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