Please use this identifier to cite or link to this item: http://hdl.handle.net/10316/10448
Title: Dynamics Study of the HO(v‘=0) + O2(v‘ ‘) Branching Atmospheric Reaction. 1. Formation of Hydroperoxyl Radical
Authors: Garrido, J. D. 
Caridade, P. J. S. B. 
Varandas, A. J. C. 
Issue Date: 24-Jun-1999
Publisher: American Chemical Society
Citation: The Journal of Physical Chemistry A. 103:25 (1999) 4815-4822
Abstract: We report a theoretical study of the title four-atom atmospheric reaction for a range of translational energies 0.1 ≤ Etr/kcal mol-1 ≤ 40 and the range 13 ≤ v‘ ‘ ≤ 27 of vibrational quantum numbers of the oxygen molecule. All calculations have employed the quasiclassical trajectory method, and a realistic potential energy surface obtained by using the double many-body expansion (DMBE) method for ground-state HO3.
URI: http://hdl.handle.net/10316/10448
ISSN: 1089-5639
DOI: 10.1021/jp990756o
Rights: openAccess
Appears in Collections:FCTUC Química - Artigos em Revistas Internacionais

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