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Dynamics Study of the OH + O 2 Branching Atmospheric Reaction. 2. Influence of Reactants Internal Energy in HO 2 and O 3 Formation

✍ Scribed by Caridade, P. J. S. B.; Zhang, L.; Garrido, J. D.; Varandas, A. J. C.

Book ID
126941312
Publisher
American Chemical Society
Year
2001
Tongue
English
Weight
132 KB
Volume
105
Category
Article
ISSN
1089-5639

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Variational transition-state theory stud
Variational transition-state theory study of the atmospheric reaction OH + O3 β†’ HO2 + O2
✍ Li-Ping Ju; Ke-Li Han; AntΓ³nio J. C. Varandas πŸ“‚ Article πŸ“… 2007 πŸ› John Wiley and Sons 🌐 English βš– 145 KB πŸ‘ 1 views

## Abstract We report variational transition‐state theory calculations for the OH + O~3~β†’ HO~2~ + O~2~ reaction based on the recently reported double many‐body expansion potential energy surface for ground‐state HO~4~ [Chem Phys Lett 2000, 331, 474]. The barrier height of 1.884 kcal mol^βˆ’1^ is comp