Citation: Xi Guang ZHFNG, Ke Li HAN, Ben Fan SUN, Qin Xing LI, Zhen Xin YU, Guo Zhong HE. THEORETICAL INVESTIGATION OF COLLISION ENERGY EFFECT ON REACTION O BARIUM WITH METHYL BROMIDE[J]. Chinese Chemical Letters, ;1993, 4(6): 513-516. shu

THEORETICAL INVESTIGATION OF COLLISION ENERGY EFFECT ON REACTION O BARIUM WITH METHYL BROMIDE

1.
State Key Laboratory of Molecular Reaction Dynamics, Dalian Institute of Chemical Physics, Chinese Academy of Science, Dalian 116023;
2.
Institute for Lasers and Spectroscopy, Zhongshan University, Guangzhou 510275

Received Date: 15 December 1992

Fund Project: We are grateful to Mr. Chengshan Liu and Mr. Hongbin Zhao for their help in employment of VAX Ⅱ computer. This work was supported in part by the National Science Fbundation of China, and by the Research Fund of Dalian Institute of Chemical Physics, Chinese Academy of Science.

The reacdynamics on Ba+BrCH₃→BaBr+CH₃ has been investigated in the first proposed potential energy surface of the generalized LEPS type,using the quasiclassical trajectory method.In simulation of the conditions in molecular beam experiments,the results of the present study show significant effect of the reagent collision energy on the dynamics of the reaction,and are in good agreement with the experimental ones.
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