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Theoretical study of stereodynamics for the reaction S(D-1)+D-2
Zhang Zhi-Hong; Chen Mao-Du; Cong Shu-Lin; Han Ke-Li
关键词Stereodynamics Long-lived Complex Polarization-dependent Differential Cross Section Polarization Parameter
刊名ACTA PHYSICO-CHIMICA SINICA
2006-05-01
DOI10.3866/PKU.WHXB20060509
22期:5页:557-560
收录类别SCI
文章类型Article
WOS标题词Science & Technology ; Physical Sciences
类目[WOS]Chemistry, Physical
研究领域[WOS]Chemistry
关键词[WOS]INITIO POTENTIAL SURFACE ; REACTION DYNAMICS ; D-2 ; HD ; POLARIZATION ; SCATTERING ; STATE
英文摘要Stereodynamics for the S(D-1)+D-2 reaction have been studied at a collision energy of 22.18 kJ.mol(-1) on an ab initio potential energy surface by using time-independent quantum reactive scattering theory. The calculated differential cross sections show forward/backward peaking with weakly asymmetry, which is in agreement with the quasiclassical and experimental results. The state-resolved polarization-dependent differential cross sections and polarization parameters show that the product polarization tends toward a less anisotropic distribution, which indicates existence of a long-lived complex during the reaction because of the existence of deep well on the potential energy surface.
语种英语
WOS记录号WOS:000237709200009
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被引频次:5[WOS]   [WOS记录]     [WOS相关记录]
文献类型期刊论文
条目标识符http://cas-ir.dicp.ac.cn/handle/321008/140337
专题中国科学院大连化学物理研究所
作者单位1.Dalian Univ Technol, Dept Phys, Dalian 116023, Peoples R China
2.Chinese Acad Sci, Dalian Inst Chem Phys, State Key Lab Mol React Dynam, Dalian 116023, Peoples R China
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Zhang Zhi-Hong,Chen Mao-Du,Cong Shu-Lin,et al. Theoretical study of stereodynamics for the reaction S(D-1)+D-2[J]. ACTA PHYSICO-CHIMICA SINICA,2006,22(5):557-560.
APA Zhang Zhi-Hong,Chen Mao-Du,Cong Shu-Lin,&Han Ke-Li.(2006).Theoretical study of stereodynamics for the reaction S(D-1)+D-2.ACTA PHYSICO-CHIMICA SINICA,22(5),557-560.
MLA Zhang Zhi-Hong,et al."Theoretical study of stereodynamics for the reaction S(D-1)+D-2".ACTA PHYSICO-CHIMICA SINICA 22.5(2006):557-560.
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