Dynamics study of the OH+O-2 branching atmospheric reaction. 3. Dissociation in collisions of vibrationally excited reactants

Citation
Pjsb. Caridade et al., Dynamics study of the OH+O-2 branching atmospheric reaction. 3. Dissociation in collisions of vibrationally excited reactants, J PHYS CH A, 105(31), 2001, pp. 7435-7440
Citations number
42
Categorie Soggetti
Physical Chemistry/Chemical Physics
Journal title
JOURNAL OF PHYSICAL CHEMISTRY A
ISSN journal
10895639 → ACNP
Volume
105
Issue
31
Year of publication
2001
Pages
7435 - 7440
Database
ISI
SICI code
1089-5639(20010809)105:31<7435:DSOTOB>2.0.ZU;2-6
Abstract
We discuss the dissociation of the OH radical in the title molecular collis ions when both species are vibrationally excited. An analysis of the O-2 di ssociation is also reported. All calculations employed the quasiclassical t rajectory method and a realistic double many-body expansion (DMBE) potentia l energy surface for groundstate HO3. The results are compared with those r eferring to formation of HO2 and O-3 under similar conditions. Possible imp lications on atmospheric models for ozone production are tentatively assess ed.