Theoretical study of the dynamics of the reaction C(3P)+CH(X2)
文献类型:期刊论文
作者 | Zhang, Hehua1,2; Hu, Changjin1,2; Wei, Qiang3; Zhang, Bing1,2 |
刊名 | molecular physics
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出版日期 | 2009 |
卷号 | 107期号:23-24页码:2503-2509 |
关键词 | quasi-classical trajectory stereodynamics vector correlation rotational polarization cross section |
英文摘要 | a theoretical study of the dynamics of the reaction c([image omitted]) + ch([image omitted]) using the quasi-classical trajectory (qct) method has been performed based on the double many-body expansion (dmbe) potential energy surface (pes) [phys. chem. chem. phys. 2, 1693 (2000)]. the integral cross section, as well as the product rotational alignment factor < p2(j' center dot k)> and four polarization-dependent differential cross sections (pddcss), i.e. [image omitted] [image omitted] [image omitted] and [image omitted] were studied. furthermore, the distribution of the dihedral angle [image omitted] and the distribution of the angle between k and j' [image omitted] are discussed. the angular distribution [image omitted] of the product rotational vector was also calculated. |
WOS标题词 | science & technology ; physical sciences |
类目[WOS] | physics, atomic, molecular & chemical |
研究领域[WOS] | physics |
关键词[WOS] | product rotational polarization ; initiated bimolecular reactions ; dependent quantum dynamics ; potential-energy surfaces ; c+ch reaction ; wave-packet ; alignment ; a+bc ; c2h ; ch |
收录类别 | SCI |
语种 | 英语 |
WOS记录号 | WOS:000272898000007 |
公开日期 | 2015-11-17 |
源URL | [http://159.226.238.44/handle/321008/141576] ![]() |
专题 | 大连化学物理研究所_中国科学院大连化学物理研究所 |
作者单位 | 1.Chinese Acad Sci, Wuhan Inst Phys & Math, State Key Lab Magnet Resonance & Atom & Mol Phys, Wuhan 430071, Peoples R China 2.Chinese Acad Sci, Grad Sch, Beijing 100049, Peoples R China 3.Chinese Acad Sci, Dalian Inst Chem Phys, State Key Lab Dynam Mol React, Dalian 116023, Peoples R China |
推荐引用方式 GB/T 7714 | Zhang, Hehua,Hu, Changjin,Wei, Qiang,et al. Theoretical study of the dynamics of the reaction C(3P)+CH(X2)[J]. molecular physics,2009,107(23-24):2503-2509. |
APA | Zhang, Hehua,Hu, Changjin,Wei, Qiang,&Zhang, Bing.(2009).Theoretical study of the dynamics of the reaction C(3P)+CH(X2).molecular physics,107(23-24),2503-2509. |
MLA | Zhang, Hehua,et al."Theoretical study of the dynamics of the reaction C(3P)+CH(X2)".molecular physics 107.23-24(2009):2503-2509. |
入库方式: OAI收割
来源:大连化学物理研究所
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