The Proceedings of the Symposium on Environmental Engineering
Online ISSN : 2424-2969
2000.10
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Computational Studies on the Reactions of N_2O with O and CO
Kentaro TSUCHIYAHiroumi SHIINAMasaaki OYA
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CONFERENCE PROCEEDINGS FREE ACCESS

Pages 252-253

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Abstract
Ab initio molecular orbital calculations were performed to derive rate expressions for the reactions of N_2O with O(3^P) and CO. Major products of O(3^P) + N_2O reactions are predicted to be NO + NO rather than N_2 + O_2. Comparisons of calculated and experimental rate constants indicate good agreement exists with the most recent experimental values.
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© 2000 The Japan Society of Mechanical Engineers
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