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An adiabatic-bend Franck-Condon model for final rotational distributions in the H + H2O and H + D2O reactions

✍ Scribed by Desheng Wang; Joel M. Bowman

Publisher: Elsevier Science
Year: 1993
Tongue: English
Weight: 745 KB
Volume: 207
Category: Article
ISSN: 0009-2614
DOI: 10.1016/0009-2614(93)87019-y

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✦ Synopsis

We report H, and OH rotational distributions for the H+H20 reaction, and HD and OD rotational distributions for the H t D,O obtain the rotational distributions. A realistic, six-degree-of-freedom potential is used to describe the four-atom reaction, and the bending eigenstates are accurately calculated using a direct-product basis of spherical harmonics for the two diatomic fragments.

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