The relation between collinear and 3-D dynamical calculations of reactive molecular collisions

R. B. Bernstein; R. D. Levine

doi:10.1016/0009-2614(74)85114-6

The relation between collinear and 3-D dynamical calculations of reactive molecular collisions

R. B. Bernstein^*, R. D. Levine

^*Corresponding author for this work

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

51 Scopus citations

Abstract

One important difference between the results of collinear and of full 3-D dynamical computations arises from the difference in the available volume in phase space (1-D versus 3-D) which can be termed a "dimensionality-bias". Correction for this phase space factor allows for a more realistic estimate of reaction cross sections, branching ratios and 3-D product energy distributions from collinear calculations.

Original language	English
Pages (from-to)	314-318
Number of pages	5
Journal	Chemical Physics Letters
Volume	29
Issue number	3
DOIs	https://doi.org/10.1016/0009-2614(74)85114-6
State	Published - 1 Dec 1974
Externally published	Yes

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title = "The relation between collinear and 3-D dynamical calculations of reactive molecular collisions",

abstract = "One important difference between the results of collinear and of full 3-D dynamical computations arises from the difference in the available volume in phase space (1-D versus 3-D) which can be termed a {"}dimensionality-bias{"}. Correction for this phase space factor allows for a more realistic estimate of reaction cross sections, branching ratios and 3-D product energy distributions from collinear calculations.",

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year = "1974",

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doi = "10.1016/0009-2614(74)85114-6",

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N2 - One important difference between the results of collinear and of full 3-D dynamical computations arises from the difference in the available volume in phase space (1-D versus 3-D) which can be termed a "dimensionality-bias". Correction for this phase space factor allows for a more realistic estimate of reaction cross sections, branching ratios and 3-D product energy distributions from collinear calculations.

AB - One important difference between the results of collinear and of full 3-D dynamical computations arises from the difference in the available volume in phase space (1-D versus 3-D) which can be termed a "dimensionality-bias". Correction for this phase space factor allows for a more realistic estimate of reaction cross sections, branching ratios and 3-D product energy distributions from collinear calculations.

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JO - Chemical Physics Letters

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The relation between collinear and 3-D dynamical calculations of reactive molecular collisions

Abstract

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