A quasi-classical trajectory study of collisions of fast H atoms with CO using an accurate ab initio potential surface

Lynn C. Geiger, George C Schatz, Lawrence B. Harding

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27 Citations (Scopus)

Abstract

The quasi-classical trajectory method is used in conjunction with a globally determined ab initio surface to study translational to vibrational excitation in collisions of hot H atoms with CO. Good agreement with experiment is obtained. Sensitivity of the results to features of the surface is analyzed.

Original languageEnglish
Pages (from-to)520-525
Number of pages6
JournalChemical Physics Letters
Volume114
Issue number5-6
DOIs
Publication statusPublished - Mar 15 1985

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ASJC Scopus subject areas

  • Physical and Theoretical Chemistry
  • Spectroscopy
  • Condensed Matter Physics
  • Atomic and Molecular Physics, and Optics
  • Surfaces and Interfaces

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