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State-to-state quantum dynamics of O + O2 isotope exchange reactions reveals nonstatistical behavior at atmospheric conditions.
- Source :
- Proceedings of the National Academy of Sciences of the United States of America; 1/12/2010, Vol. 107 Issue 2, p555-558, 4p, 4 Graphs
- Publication Year :
- 2010
-
Abstract
- The 0 + 02 exchange reaction is a prerequisite for the formation of ozone in Earth's atmosphere. We report here state-to-state differential and integral cross sections for several O + O<subscript>2</subscript> isotope- exchange reactions obtained by dynamically exact quantum scattering calculations at collision energies relevant to atmospheric conditions. These reactions are shown to be highly nonstatistical, evidenced by dominant forward scattering and deviation of the integral cross section from the statistical limit. Mechanistic,analyses revealed that the nonstatistical channel is facilitated by short- lived osculating resonances. The theoretical results provided an in-depth interpretation of a recent molecular beam experiment of the exchange reaction and shed light on the initial step of ozone recombination. [ABSTRACT FROM AUTHOR]
Details
- Language :
- English
- ISSN :
- 00278424
- Volume :
- 107
- Issue :
- 2
- Database :
- Complementary Index
- Journal :
- Proceedings of the National Academy of Sciences of the United States of America
- Publication Type :
- Academic Journal
- Accession number :
- 47901990
- Full Text :
- https://doi.org/10.1073/pnas.0911356107