Please use this identifier to cite or link to this item: http://hdl.handle.net/10316/10355
Title: Dynamics Study of the OH + O3 Atmospheric Reaction with Both Reactants Vibrationally Excited
Authors: Zhang, Lei 
Luo, Pingya 
Huang, Zhiyu 
Varandas, António J. C. 
Issue Date: 28-Dec-2006
Publisher: American Chemical Society
Citation: The Journal of Physical Chemistry A. 110:51 (2006) 13836-13842
Abstract: The dynamics of the title five-atom atmospheric reaction is studied by the quasiclassical trajectory method for vibrational states of OH over the range 2 ≤ v ≤ 9 and initial vibrational energies of O3 between 9 and 21 kcal mol-1 using a previously reported double many-body expansion potential energy surface for HO4(2A). The results show that the reaction is controlled by both capture- and barrier-type mechanisms, with the rate constants depending strongly on the reactants' internal energy content. Also suggested from the magnitude of the calculated rate coefficients is that the title processes may not be ignorable when studying the stratospheric ozone budget.
URI: http://hdl.handle.net/10316/10355
ISSN: 1089-5639
DOI: 10.1021/jp066273j
Rights: openAccess
Appears in Collections:FCTUC Química - Artigos em Revistas Internacionais

Files in This Item:
File Description SizeFormat
Dynamics Study of the OH + O3 Atmospheric Reaction.pdf123.91 kBAdobe PDFView/Open
Show full item record

SCOPUSTM   
Citations

8
checked on May 29, 2020

WEB OF SCIENCETM
Citations 10

8
checked on Jul 2, 2021

Page view(s)

178
checked on Jul 22, 2021

Download(s) 20

630
checked on Jul 22, 2021

Google ScholarTM

Check

Altmetric

Altmetric


Items in DSpace are protected by copyright, with all rights reserved, unless otherwise indicated.