Modeling the F+H2S reaction with an F+HS potential

Haya Kornweitz; Avigdor Persky

doi:10.1016/S0009-2614(99)00540-0

Modeling the F+H₂S reaction with an F+HS potential

Haya Kornweitz, Avigdor Persky

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

3 Scopus citations

Abstract

The F+H₂S reaction is modeled by an F+HX three-center LEPS potential energy surface. Trajectory calculations carried out on this surface reproduced quite well the experimental results with regard to rate constants and energy distribution among the products, for the reactions F+H₂S and F+D₂S. This surface was also used for calculating the angular distribution of the products for various initial conditions. The results are presented and discussed.

Original language	English
Pages (from-to)	479-483
Number of pages	5
Journal	Chemical Physics Letters
Volume	307
Issue number	5-6
DOIs	https://doi.org/10.1016/S0009-2614(99)00540-0
State	Published - 9 Jul 1999
Externally published	Yes

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10.1016/S0009-2614(99)00540-0

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title = "Modeling the F+H2S reaction with an F+HS potential",

abstract = "The F+H2S reaction is modeled by an F+HX three-center LEPS potential energy surface. Trajectory calculations carried out on this surface reproduced quite well the experimental results with regard to rate constants and energy distribution among the products, for the reactions F+H2S and F+D2S. This surface was also used for calculating the angular distribution of the products for various initial conditions. The results are presented and discussed.",

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AU - Persky, Avigdor

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N2 - The F+H2S reaction is modeled by an F+HX three-center LEPS potential energy surface. Trajectory calculations carried out on this surface reproduced quite well the experimental results with regard to rate constants and energy distribution among the products, for the reactions F+H2S and F+D2S. This surface was also used for calculating the angular distribution of the products for various initial conditions. The results are presented and discussed.

AB - The F+H2S reaction is modeled by an F+HX three-center LEPS potential energy surface. Trajectory calculations carried out on this surface reproduced quite well the experimental results with regard to rate constants and energy distribution among the products, for the reactions F+H2S and F+D2S. This surface was also used for calculating the angular distribution of the products for various initial conditions. The results are presented and discussed.

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Modeling the F+H₂S reaction with an F+HS potential

Abstract

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