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Multicoefficient Gaussian-3 Calculation of the Rate Constant for the OH + CH 4 Reaction and Its 12 C/ 13 C Kinetic Isotope Effect with Emphasis on the Effects of Coordinate System and Torsional Treatment

✍ Scribed by Ellingson, Benjamin A.; Pu, Jingzhi; Lin, Hai; Zhao, Yan; Truhlar, Donald G.

Book ID: 121414762
Publisher: American Chemical Society
Year: 2007
Tongue: English
Weight: 239 KB
Volume: 111
Category: Article
ISSN: 1089-5639
DOI: 10.1021/jp072843j

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