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Path-dependent variational effects and multidimensional tunneling in multi-path variational transition state theory: Rate constants calculated for the reactions of HO2 with tert-butanol by including all 46 paths for abstraction at C and all six paths for abstraction at by Bao, Junwei Lucas; Sripa, Pattrawan; Truhlar, D G is a Chemistry article available to read on EtoBox.

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Author
Bao, Junwei Lucas; Sripa, Pattrawan; Truhlar, D G
Publisher
Royal Society of Chemistry; The Royal Society of Chemistry; Royal Society of Chemistry (RSC) (ISSN 1463-9076)
Published
2015
Language
EN
Field
Chemistry (Physical Sciences)

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