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题名: A detailed dynamics study of the reaction CH4+Cl -> HCl+CH3
作者: Xu, LJ;  Wang, XB;  Yan, JM;  Kong, FA
关键词: quasiclassical trajectory calculation ;  LEPS potential energy surface
刊名: CHINESE CHEMICAL LETTERS
发表日期: 1998-08-01
卷: 9, 期:8, 页:771-774
收录类别: SCI
文章类型: Article
WOS标题词: Science & Technology ;  Physical Sciences
类目[WOS]: Chemistry, Multidisciplinary
研究领域[WOS]: Chemistry
英文摘要: The detailed dynamics of the CH4 + Cl --> HCl + CH3 reaction has been investigated by means of the quasiclassical trajectory approach. The properties analyzed can be interpreted in terms of the main topological features of the potential energy surface used. On the basis of the theoretical results, two reaction channels are proposed: one is a direct channel and the other is a complex one.
语种: 英语
WOS记录号: WOS:000083722500025
Citation statistics: 
内容类型: 期刊论文
URI标识: http://cas-ir.dicp.ac.cn/handle/321008/138477
Appears in Collections:中国科学院大连化学物理研究所_期刊论文

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作者单位: 1.Chinese Acad Sci, Inst Chem, State Key Lab Mol React Dynam, Beijing 100080, Peoples R China

Recommended Citation:
Xu, LJ,Wang, XB,Yan, JM,et al. A detailed dynamics study of the reaction CH4+Cl -> HCl+CH3[J]. CHINESE CHEMICAL LETTERS,1998,9(8):771-774.
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