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: Vector correlation in the H+D-2 reaction and its isotopic variants: isotope effect on stereodynamics
作者: Chen, MD;  Han, KL;  Lou, NQ
刊名: CHEMICAL PHYSICS LETTERS
发表日期: 2002-05-17
卷: 357, 期:5-6, 页:483-490
收录类别: SCI
文章类型: Article
WOS标题词: Science & Technology ;  Physical Sciences
类目[WOS]: Chemistry, Physical ;  Physics, Atomic, Molecular & Chemical
研究领域[WOS]: Chemistry ;  Physics
英文摘要: The vector correlations in the H + D-2 reaction and its isotopic variants at a collision energy of 35.7 kcal/mol have been studied by using quasiclassical trajectories on two potential energy surfaces (PESs), one from BKMP2, and the other from LSTH. And the isotope effect on dynamical stereochemistry is discussed in detail. The calculations indicate that the distribution of the product angular momentum vector is sensitive to the mass factor. The agreement of the results calculated on both the LSTH and BKMP2 PESs probably implies that the product rotational polarization is mainly controlled by the saddle point properties on PES, (C) 2002 Published by Elsevier Science B.V.
关键词[WOS]: PRODUCT ROTATIONAL POLARIZATION ;  DIFFERENTIAL CROSS-SECTIONS ;  PHOTOINITIATED BIMOLECULAR REACTIONS ;  STATE-RESOLVED STEREODYNAMICS ;  ANGULAR-MOMENTUM POLARIZATION ;  VIBRATIONALLY EXCITED METHANE ;  CHEMICAL-REACTIONS ;  SCATTERING-ANGLE ;  ALIGNMENT ;  DISTRIBUTIONS
语种: 英语
WOS记录号: WOS:000175958900025
Citation statistics: 
内容类型: 期刊论文
URI标识: http://cas-ir.dicp.ac.cn/handle/321008/139120
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, State Key Lab Mol React Dynam, Ctr Computat Chem, Dalian 116023, Peoples R China

Recommended Citation:
Chen, MD,Han, KL,Lou, NQ. Vector correlation in the H+D-2 reaction and its isotopic variants: isotope effect on stereodynamics[J]. CHEMICAL PHYSICS LETTERS,2002,357(5-6):483-490.
Service
 Recommend this item
 Sava as my favorate item
 Show this item's statistics
 Export Endnote File
Google Scholar
 Similar articles in Google Scholar
 [Chen, MD]'s Articles
 [Han, KL]'s Articles
 [Lou, NQ]'s Articles
CSDL cross search
 Similar articles in CSDL Cross Search
 [Chen, MD]‘s Articles
 [Han, KL]‘s Articles
 [Lou, NQ]‘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