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Citation: KONG Hao, LIU Xin-Guo, XU Wen-Wu, ZHANG Qing-Gang. A Quasi-Classical Trajectory Study on the Effect of Reagent Vibrational Excitation on the Reaction of He+H⁺₂→HeH⁺+H[J]. Acta Physico-Chimica Sinica, ;2009, 25(05): 935-940. doi: 10.3866/PKU.WHXB20090520 shu

A Quasi-Classical Trajectory Study on the Effect of Reagent Vibrational Excitation on the Reaction of He+H⁺₂→HeH⁺+H

1.
College of Physics and Electronics, Shandong Normal University, Jinan 250014, P. R. China

Received Date: 1 December 2008
Available Online: 18 March 2009

We studied the dynamical stereochemistry of the He+H+2 (v=0-2, j=0)→HeH++Hreactions using the quasi-classical trajectory (QCT) method on a PPA surface (Palmieri, P. ; Puzzarini, C.; Aquilanti, V. Mol. Phys., 2000, 98: 1835). Results indicate that the reagent's vibrational excitation has a considerable influence on the distributions of the k-j' correlation and the k-k'-j' correlation. In addition, polarization dependent generalized differential cross-sections were found to be sensitive to the vibrational number.
- Vector correlation,
- Polarization dependent differential cross section,
- Vibrational number,
- Quasi-classical trajectory method
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沈阳化工大学材料科学与工程学院沈阳 110142

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A Quasi-Classical Trajectory Study on the Effect of Reagent Vibrational Excitation on the Reaction of He+H+2→HeH++H

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通讯作者: 陈斌, bchen63@163.com

A Quasi-Classical Trajectory Study on the Effect of Reagent Vibrational Excitation on the Reaction of He+H⁺₂→HeH⁺+H