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https://hdl.handle.net/10316/10405
Title: | Dynamics Study of the O + HO2 Reaction Using Two DMBE Potential Energy Surfaces: The Role of Vibrational Excitation | Authors: | Silveira, Dora M. Caridade, Pedro J. S. B. Varandas, António J. C. |
Issue Date: | 14-Oct-2004 | Publisher: | American Chemical Society | Citation: | The Journal of Physical Chemistry A. 108:41 (2004) 8721-8730 | Abstract: | We investigate the effect of vibrational excitation on the dynamics and kinetics of the atmospheric reaction O(3P) + HO2 → OH + O2 using two double many-body expansion potential energy surfaces previously reported. The results show that such an effect is relatively minor even considering HO2 with contents of vibrational excitation close to the H + O2 dissociation asymptote. It should therefore not bear drastic implications in atmospheric modeling where such an effect has been ignored thus far. | URI: | https://hdl.handle.net/10316/10405 | ISSN: | 1089-5639 | DOI: | 10.1021/jp049575z | Rights: | openAccess |
Appears in Collections: | FCTUC Química - Artigos em Revistas Internacionais |
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Dynamics Study of the O + HO2 Reaction Using Two DMBE.pdf | 287.49 kB | Adobe PDF | View/Open |
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