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Nuclear spin selection rules for reactive collision systems by the spin-modification probability method

The spin-modification probability (SMP) method, which provides fundamental and detailed quantitative information on the nuclear spin selection rules, is discussed more systematically and generalized for reactive collision systems involving more than one configuration of reactant and product molecule...

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Bibliographic Details
Published in:The Journal of chemical physics 2007-12, Vol.127 (22), p.224101-224101
Main Authors: Park, Kisam, Light, John C
Format: Article
Language:English
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Summary:The spin-modification probability (SMP) method, which provides fundamental and detailed quantitative information on the nuclear spin selection rules, is discussed more systematically and generalized for reactive collision systems involving more than one configuration of reactant and product molecules, explicitly taking account of the conservation of the overall nuclear spin symmetry as well as the conservation of the total nuclear spin angular momentum, under the assumption of no nuclear hyperfine interaction. The values of SMP once calculated can be used for any system of identical nuclei of any spin as long as the system has the corresponding nuclear spin symmetry. The values of SMP calculated for simple systems can also be used for more complex systems containing several kinds of identical nuclei or various isotopomers. The generalized formulation of statistical scattering theory which can easily represent various rearrangement mechanisms is also presented.
ISSN:0021-9606
1089-7690
DOI:10.1063/1.2805394