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Variational transition state theory calculations of thermal rate coefficients for the Q(3P) + HCl reaction

  • Thomas C. Allison
  • , B. Ramachandran
  • , Jörg Senekowitsch
  • , Donald G. Truhlar
  • , Robert E. Wyatt
  • University of Minnesota
  • Louisiana Tech University
  • Idaho State University
  • University of Texas at Austin

Research output: Contribution to journalArticlepeer-review

Original languageEnglish
Pages (from-to)307-314
Number of pages8
JournalJournal of Molecular Structure: THEOCHEM
Volume454
Issue number2-3
DOIs
StatePublished - Nov 28 1998
Externally publishedYes

ASJC Scopus Subject Areas

  • Biochemistry
  • Condensed Matter Physics
  • Physical and Theoretical Chemistry

Keywords

  • Potential surfaces
  • Rate coefficients
  • Reaction barriers
  • Transition state theory

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