Quasiclassical trajectory study of reaction of chlorine substituting the primary hydrogen of propane
文献类型:期刊论文
作者 | Zhang, TL; Yan, JM; Kong, FA |
刊名 | ACTA PHYSICO-CHIMICA SINICA
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出版日期 | 2001-02-01 |
卷号 | 17期号:2页码:119-122 |
关键词 | Quasiclassical Trajectory Calculation Propane Primary Hydrogen Collision Complex |
ISSN号 | 1000-6818 |
DOI | 10.3866/PKU.WHXB20010206 |
英文摘要 | 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. |
语种 | 英语 |
WOS记录号 | WOS:000167285500006 |
出版者 | PEKING UNIV PRESS |
源URL | [http://ir.iccas.ac.cn/handle/121111/77233] ![]() |
专题 | 中国科学院化学研究所 |
通讯作者 | Yan, JM |
作者单位 | Chinese Acad Sci, Inst Chem, Beijing 100080, Peoples R China |
推荐引用方式 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. |
入库方式: OAI收割
来源:化学研究所
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