Journal article

Insertion and abstraction pathways in the reaction O(1D2) + H2-->OH+H.

Abstract:: Rigorous quantum dynamical calculations have been performed on the ground 1 1A' and first excited 1 1A" electronic states of the title reaction, employing the most accurate potential energy surfaces available. Product rovibrational quantum state populations and rotational angular momentum alignment parameters are reported, and are compared with new experimental, and quasiclassical trajectory calculated results. The quantum calculations agree quantitatively with experiment, and reveal unequivocally that the 1 1A" excited state participates in the reaction.

Publication status:: Published

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APA Style

Aoiz, F., Bañares, L., Castillo, J., Brouard, M., Denzer, W., Vallance, C., Honvault, P., Launay, J., Dobbyn, A., & Knowles, P. (2001). Insertion and abstraction pathways in the reaction O(1D2) + H2-->OH+H. Physical Review Letters, 86(9), 1729–1732.

MLA Style

Aoiz, F, et al. “Insertion and Abstraction Pathways in the Reaction O(1D2) + H2--OH+H.” Physical Review Letters, vol. 86, no. 9, 2001, pp. 1729–32.

Chicago Style

Aoiz, F, L Bañares, J Castillo, et al. 2001. “Insertion and Abstraction Pathways in the Reaction O(1D2) + H2--OH+H.” Physical Review Letters 86 (9): 1729–32.
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Publisher copy:: 10.1103/physrevlett.86.1729

Authors

+ Aoiz, F More by this author

Role:: Author

+ Bañares, L More by this author

Role:: Author

+ Castillo, J More by this author

Role:: Author

+ Brouard, M More by this author

Institution:: University of Oxford
Division:: MPLS
Department:: Chemistry
Sub department:: Physical & Theoretical Chem
Role:: Author

+ Denzer, W More by this author

Role:: Author

More authors...

Publisher:: American Inst of Physics
Journal:: Physical Review Letters More from this journal
Volume:: 86
Issue:: 9
Pages:: 1729-1732
Publication date:: 2001-02-01
DOI:: 10.1103/physrevlett.86.1729
EISSN:: 1079-7114
ISSN:: 0031-9007

Language:: English
Pubs id:: pubs:31862
UUID:: uuid:11f6d195-05a7-44a5-9d18-d16f004ca0ea
Local pid:: pubs:31862
Source identifiers:: 31862
Deposit date:: 2012-12-19
ARK identifier:: ark:/29072/ora_11f6d19505a744a59d18d16f004ca0ea

Terms of use

Copyright date:: 2001

Licence:: Terms and Conditions of Use for Oxford University Research Archive

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