A quasiclassical trajectory study of product energy and angular distributions for the OH+D2 reaction

Matthew J. Lakin, Diego Troya, György Lendvay, Miguel González*, George C. Schatz

*Corresponding author for this work

Research output: Contribution to journalArticlepeer-review

19 Scopus citations

Abstract

The quasiclassical trajectory method was used to determine product energy disposal, vibrational state populations and angular distributions for the OH+D2→HOD+D reaction with WSLFH and OC potential energy surfaces (PES). Angular distributions and the trends with increasing translational energy and vibrationally exciting reagents were also presented. It was shown that both surfaces satisfactorily reproduces the measured average fraction of energy and HOD vibrational distributions.

Original languageEnglish (US)
Pages (from-to)5160-5169
Number of pages10
JournalJournal of Chemical Physics
Volume115
Issue number11
DOIs
StatePublished - Sep 15 2001

ASJC Scopus subject areas

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

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