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Quasiclassical trajectory study of reaction of chlorine substituting the primary hydrogen of propane | |
Zhang, TL; Yan, JM; Kong, FA | |
2001-02-01 | |
Source Publication | ACTA PHYSICO-CHIMICA SINICA
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ISSN | 1000-6818 |
Volume | 17Issue:2Pages:119-122 |
Abstract | The reaction of Cl substituting the primary hydrogen of C3H3 was investigated by quasiclassical trajectory method. The three-body LEPS potential function was used to build the potential surface of the reaction system. It shows that for the reaction of Cl substituting the primary hydrogen of C3H8, there are two reaction channels, the first one is a direct reaction process; while the other goes through a collisional complex. |
Keyword | Quasiclassical Trajectory Calculation Propane Primary Hydrogen Collision Complex |
DOI | 10.3866/PKU.WHXB20010206 |
Indexed By | SCI |
Language | 英语 |
WOS ID | WOS:000167285500006 |
Publisher | PEKING UNIV PRESS |
Citation statistics | |
Document Type | 期刊论文 |
Identifier | http://ir.iccas.ac.cn/handle/121111/77234 |
Collection | 中国科学院化学研究所 |
Corresponding Author | Yan, JM |
Affiliation | Chinese Acad Sci, Inst Chem, Beijing 100080, Peoples R China |
Recommended Citation GB/T 7714 | Zhang, TL,Yan, JM,Kong, FA. Quasiclassical trajectory study of reaction of chlorine substituting the primary hydrogen of propane[J]. ACTA PHYSICO-CHIMICA SINICA,2001,17(2):119-122. |
APA | Zhang, TL,Yan, JM,&Kong, FA.(2001).Quasiclassical trajectory study of reaction of chlorine substituting the primary hydrogen of propane.ACTA PHYSICO-CHIMICA SINICA,17(2),119-122. |
MLA | Zhang, TL,et al."Quasiclassical trajectory study of reaction of chlorine substituting the primary hydrogen of propane".ACTA PHYSICO-CHIMICA SINICA 17.2(2001):119-122. |
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