Comparison between hydrogen‐transfer and fluoro‐transfer reactions on the microcanonical unimolecular rate constants

Wen‐Lin ‐L Feng; Shao‐Wen ‐W Zhang; Yan Wang; Jun‐Nan ‐N Wu; Zong‐He ‐H Li

doi:10.1002/cjoc.19950130503

Comparison between hydrogen‐transfer and fluoro‐transfer reactions on the microcanonical unimolecular rate constants

Wen‐Lin ‐L Feng^*
, Shao‐Wen ‐W Zhang
, Yan Wang
, Jun‐Nan ‐N Wu
, Zong‐He ‐H Li

^*Corresponding author for this work

Beijing Normal University

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

Abstract

The microcanonical rate constants for the hydrogen‐transfer process of HCCF (reaction 7) and the fluoro‐transfer process of FCCF (reaction 8) are carried out with tunneling correction and curvature correction. The results show that the tunneling effects and curvature effects on the rate constant of reaction 7 is quite different from that of reaction 8. The rate constants for different rotational states are also studied for these reactions.

Original language	English
Pages (from-to)	391-395
Number of pages	5
Journal	Chinese Journal of Chemistry
Volume	13
Issue number	5
DOIs	https://doi.org/10.1002/cjoc.19950130503
Publication status	Published - Sept 1995
Externally published	Yes

Keywords

Microcanonical rate constant
curvature correction
tunneling effect

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10.1002/cjoc.19950130503

Cite this

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abstract = "The microcanonical rate constants for the hydrogen‐transfer process of HCCF (reaction 7) and the fluoro‐transfer process of FCCF (reaction 8) are carried out with tunneling correction and curvature correction. The results show that the tunneling effects and curvature effects on the rate constant of reaction 7 is quite different from that of reaction 8. The rate constants for different rotational states are also studied for these reactions.",

keywords = "Microcanonical rate constant, curvature correction, tunneling effect",

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year = "1995",

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T1 - Comparison between hydrogen‐transfer and fluoro‐transfer reactions on the microcanonical unimolecular rate constants

AU - Feng, Wen‐Lin ‐L

AU - Zhang, Shao‐Wen ‐W

AU - Wang, Yan

AU - Wu, Jun‐Nan ‐N

AU - Li, Zong‐He ‐H

PY - 1995/9

Y1 - 1995/9

N2 - The microcanonical rate constants for the hydrogen‐transfer process of HCCF (reaction 7) and the fluoro‐transfer process of FCCF (reaction 8) are carried out with tunneling correction and curvature correction. The results show that the tunneling effects and curvature effects on the rate constant of reaction 7 is quite different from that of reaction 8. The rate constants for different rotational states are also studied for these reactions.

AB - The microcanonical rate constants for the hydrogen‐transfer process of HCCF (reaction 7) and the fluoro‐transfer process of FCCF (reaction 8) are carried out with tunneling correction and curvature correction. The results show that the tunneling effects and curvature effects on the rate constant of reaction 7 is quite different from that of reaction 8. The rate constants for different rotational states are also studied for these reactions.

KW - Microcanonical rate constant

KW - curvature correction

KW - tunneling effect

UR - https://www.scopus.com/pages/publications/84984369487

U2 - 10.1002/cjoc.19950130503

DO - 10.1002/cjoc.19950130503

M3 - Article

AN - SCOPUS:84984369487

SN - 1001-604X

VL - 13

SP - 391

EP - 395

JO - Chinese Journal of Chemistry

JF - Chinese Journal of Chemistry

IS - 5

ER -

Comparison between hydrogen‐transfer and fluoro‐transfer reactions on the microcanonical unimolecular rate constants

Abstract

Keywords

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