A quasiclassical trajectory study of bond specific chemistry in the reaction H+HOD→H2+OD, HD+OH

Kathleen Kudla, George C Schatz*

*Corresponding author for this work

Research output: Contribution to journalArticlepeer-review

47 Scopus citations

Abstract

We present a quasiclassical trajectory study of H+HOD(ν1, ν2, ν3) with an emphasis on how the reaction cross section and the branching between OH and OD products varies with the initial vibrational state of HOD and with relative translational energy. Comparison of the results for initial states (100) and (001) with recent measurements by Zare and co-workers, and for the 4νOH overtone with recent measurements by Crim and co-workers indicates good qualitative agreement.

Original languageEnglish (US)
Pages (from-to)507-511
Number of pages5
JournalChemical Physics Letters
Volume193
Issue number6
DOIs
StatePublished - Jun 12 1992

ASJC Scopus subject areas

  • Physics and Astronomy(all)
  • Physical and Theoretical Chemistry

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