中国科学院大连化学物理研究所机构知识库
Advanced  
DICP OpenIR  > 中国科学院大连化学物理研究所  > 期刊论文
题名: Product rotational polarization: Stereodynamics of the reaction Cl(P-2(3/2))+CD4(v=0,j=0)-> DCl(v(')=0,j '=1)+CD3
作者: Zhang, L;  Chen, MD;  Wang, ML;  Han, KL
刊名: JOURNAL OF CHEMICAL PHYSICS
发表日期: 2000-02-22
卷: 112, 期:8, 页:3710-3716
收录类别: SCI
文章类型: Article
WOS标题词: Science & Technology ;  Physical Sciences
类目[WOS]: Physics, Atomic, Molecular & Chemical
研究领域[WOS]: Physics
英文摘要: The angular momentum polarization of the products of the reaction Cl(P-2(3/2))+CD4(v=0,j=0)--> DCl(v'=0,j'=1)+CD3 is calculated via the quasiclassical trajectory method (QCT) based on extended London-Eyring-Polanyi-Sato (LEPS) potential energy surface (PES) at a collision energy of 0.28 eV (6.46 kcal/mol). In the stationary target frame (STF), the rotational alignment factor A(0)((2)stf) has been calculated. In the meantime, we also present four polarization dependent "generalized" differential cross sections (PDDCS) (2 pi/sigma)(d sigma(00)/d omega(t)), (2 pi/sigma)(d sigma(20)/d omega(t)), (2 pi/sigma)(d sigma 22+/d omega(t)), and (2 pi/sigma)(d sigma 21-/d omega(t)) in the center of mass frame. Furthermore, the distribution of dihedral angle P(phi(r)), the distribution of angle between k' and J', P(theta(tr)), and the angular distribution of product rotational vectors in the form of polar plots in theta(r) and phi(r) are calculated as well. The calculated results are in good agreement with the experimental data. (C) 2000 American Institute of Physics. [S0021-9606(00)00107-0].
关键词[WOS]: DIFFERENTIAL-CROSS-SECTIONS ;  ANGULAR-MOMENTUM POLARIZATION ;  TRANSITION-STATE REGION ;  BIMOLECULAR REACTIONS ;  CHEMICAL-REACTIONS ;  CL+CH4->HCL+CH3 REACTION ;  STATISTICAL-THEORY ;  SCATTERING-ANGLE ;  ALIGNMENT ;  DYNAMICS
语种: 英语
WOS记录号: WOS:000085345300027
Citation statistics: 
内容类型: 期刊论文
URI标识: http://cas-ir.dicp.ac.cn/handle/321008/138804
Appears in Collections:中国科学院大连化学物理研究所_期刊论文

Files in This Item:

There are no files associated with this item.


作者单位: 1.Chinese Acad Sci, Dalian Inst Chem Phys, Computat Ctr Chem, Dalian 116023, Peoples R China
2.Chinese Acad Sci, Dalian Inst Chem Phys, State Key Lab Mol React Dynam, Dalian 116023, Peoples R China

Recommended Citation:
Zhang, L,Chen, MD,Wang, ML,et al. Product rotational polarization: Stereodynamics of the reaction Cl(P-2(3/2))+CD4(v=0,j=0)-> DCl(v(')=0,j '=1)+CD3[J]. JOURNAL OF CHEMICAL PHYSICS,2000,112(8):3710-3716.
Service
 Recommend this item
 Sava as my favorate item
 Show this item's statistics
 Export Endnote File
Google Scholar
 Similar articles in Google Scholar
 [Zhang, L]'s Articles
 [Chen, MD]'s Articles
 [Wang, ML]'s Articles
CSDL cross search
 Similar articles in CSDL Cross Search
 [Zhang, L]‘s Articles
 [Chen, MD]‘s Articles
 [Wang, ML]‘s Articles
Related Copyright Policies
Null
Social Bookmarking
  Add to CiteULike  Add to Connotea  Add to Del.icio.us  Add to Digg  Add to Reddit 
所有评论 (0)
暂无评论
 
评注功能仅针对注册用户开放,请您登录
您对该条目有什么异议,请填写以下表单,管理员会尽快联系您。
内 容:
Email:  *
单位:
验证码:   刷新
您在IR的使用过程中有什么好的想法或者建议可以反馈给我们。
标 题:
 *
内 容:
Email:  *
验证码:   刷新

Items in IR are protected by copyright, with all rights reserved, unless otherwise indicated.

 

 

Valid XHTML 1.0!
Powered by CSpace