首页 | 本学科首页   官方微博 | 高级检索  
     

Stereodynamics study of the H′(^2S) + NH(X^3∑-) 〉 N(4S) + H2 reaction
作者姓名:魏强
作者单位:Department of Applied Physics, Chongqing University of Technology, Chongqing 400050, China
基金项目:Project supported by the National Natural Science Foundation of China (Grant Nos.11204392 and 11047125)
摘    要:The stereodynamics and reaction mechanism of the H′(^2S) + NH (X^3∑^-) → N(^4S) + H2 reaction are thoroughly studied at collision energies in the 0.1 eV-1.0 eV range using the quasiclassical trajectory (QCT) on the ground 4A″ potential energy surface (PES). The distributions of vector correlations between products and reagents P(φr), P(φr) and P(φr,φr) are presented and discussed. The results indicate that product rotational angular momentum j′ is not only aligned, but also oriented along the direction perpendicular to the scattering plane; further, the product H2 presents different rotational polarization behaviors for different collision energies. Furthermore, four polarization-dependent differential cross sections (PDDCSs) of the product He are also calculated at different collision energies. The reaction mechanism is analyzed based on the stereodynamics properties. It is found that the abstraction mechanism is appropriate for the title reaction.

关 键 词:quasiclassical trajectory  H’  +NH reaction  stereodynamics  mechanism  
收稿时间:2013-04-06
本文献已被 CNKI 维普 等数据库收录!
点击此处可从《中国物理 B》浏览原始摘要信息
点击此处可从《中国物理 B》下载免费的PDF全文
设为首页 | 免责声明 | 关于勤云 | 加入收藏

Copyright©北京勤云科技发展有限公司  京ICP备09084417号