Orientation dependence of the H + D2 reaction cross section: Steric model vs. trajectory calculations

N. C. Blais; R. B. Bernstein; R. D. Levine

doi:10.1021/j100247a005

Orientation dependence of the H + D₂ reaction cross section: Steric model vs. trajectory calculations

N. C. Blais, R. B. Bernstein^*, R. D. Levine

^*Corresponding author for this work

Institute of Chemistry

Research output: Contribution to journal › Article › peer-review

33 Scopus citations

Abstract

Quasiclassical trajectory calculations of the orientation dependence of the cross section for the H + D₂ → HD + D reaction have been carried out at collision energies of 0.55 and 1.30 eV. The results are well approximated by the angle-dependent barrier, line-of-centers steric model of Levine and Bernstein.

Original language	English
Pages (from-to)	10-13
Number of pages	4
Journal	Journal of Physical Chemistry
Volume	89
Issue number	1
DOIs	https://doi.org/10.1021/j100247a005
State	Published - 1985

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title = "Orientation dependence of the H + D2 reaction cross section: Steric model vs. trajectory calculations",

abstract = "Quasiclassical trajectory calculations of the orientation dependence of the cross section for the H + D2 → HD + D reaction have been carried out at collision energies of 0.55 and 1.30 eV. The results are well approximated by the angle-dependent barrier, line-of-centers steric model of Levine and Bernstein.",

author = "Blais, {N. C.} and Bernstein, {R. B.} and Levine, {R. D.}",

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AU - Bernstein, R. B.

AU - Levine, R. D.

PY - 1985

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AB - Quasiclassical trajectory calculations of the orientation dependence of the cross section for the H + D2 → HD + D reaction have been carried out at collision energies of 0.55 and 1.30 eV. The results are well approximated by the angle-dependent barrier, line-of-centers steric model of Levine and Bernstein.

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Orientation dependence of the H + D₂ reaction cross section: Steric model vs. trajectory calculations

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