Theoretical study on mechanisms of the high-temperature reactions C2H3 + H2O and C2H4 + OHElectronic supplementary information (ESI) available: Figures of optimized geometries of the fragments of C2H5O radicals, C2H5O isomers and C2H5O transition states and table of harmonic vibration frequencies of C2H3, H2O, TSR/P1, C2H4 and OH. See http://www.rsc.org/suppdata/cp/b1/b109758j

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Bibliographic Details
Published inPhysical chemistry chemical physics : PCCP Vol. 4; no. 6; pp. 1021 - 1027
Main Authors Liu, Gui-xia, Ding, Yi-hong, Li, Ze-sheng, Fu, Qiang, Huang, Xu-ri, Sun, Chia-chung, Tang, Au-chin
Format Journal Article
LanguageEnglish
Published 04.03.2002
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ISSN1463-9076
1463-9084
DOI10.1039/b109758j

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ISSN:1463-9076
1463-9084
DOI:10.1039/b109758j