Surface Corrugation in Rotational and Diffractive Scattering of O-2 from LiF (001)

doi:10.1088/0253-6102/54/6/27

IMR OpenIR

	Surface Corrugation in Rotational and Diffractive Scattering of O-2 from LiF (001)
	Xu Kai 1; Chen Xiang-Rong 1,2; Wei Dong-Qing 3; Gou Qing-Quan 1
通讯作者	Chen Xiang-Rong(x.r.chen@tom.com)
	2010-12-01
发表期刊	COMMUNICATIONS IN THEORETICAL PHYSICS
ISSN	0253-6102
卷号	54 期号:6 页码:1112-1120
摘要	A quantum dynamic calculation on a five-dimensional O-2/LiF (001) model system is performed using the multi-configuration time-dependent Hartree method. The obtained results show that the mechanism of rotational and diffractive excitation in details: Comparison with the rotational excited state, the initially non-rotational state is seen to favor the inelastic scattering in the rotational excitation process. The surface corrugation can damp the quantum interferences and produce a greater amount of rotational inelastic scattering at the expense of the elastic process in the rotational excitation process. The diffraction process and the average energy transferred into the rotational and diffractive mode are also discussed.
关键词	molecule-surface scattering surface corrugation multi-configuration time-dependent Hartree method
资助者	Natural Science Foundation of China ; Specialized Research Fund for the Doctoral Program of Higher Education
DOI	10.1088/0253-6102/54/6/27
收录类别	SCI
语种	英语
资助项目	Natural Science Foundation of China[10776022] ; Specialized Research Fund for the Doctoral Program of Higher Education[20090181110080]
WOS研究方向	Physics
WOS类目	Physics, Multidisciplinary
WOS记录号	WOS:000285409300027
出版者	IOP PUBLISHING LTD
引用统计
文献类型	期刊论文
条目标识符	http://ir.imr.ac.cn/handle/321006/102851
专题	中国科学院金属研究所
通讯作者	Chen Xiang-Rong
作者单位	1.Sichuan Univ, Coll Phys Sci & Technol, Inst Atom & Mol Phys, Chengdu 610064, Peoples R China 2.Chinese Acad Sci, Int Ctr Mat Phys, Shenyang 110016, Peoples R China 3.Shanghai Jiao Tong Univ, Coll Life Sci & Biotechnol, Shanghai 200240, Peoples R China
推荐引用方式 GB/T 7714	Xu Kai,Chen Xiang-Rong,Wei Dong-Qing,et al. Surface Corrugation in Rotational and Diffractive Scattering of O-2 from LiF (001)[J]. COMMUNICATIONS IN THEORETICAL PHYSICS,2010,54(6):1112-1120.
APA	Xu Kai,Chen Xiang-Rong,Wei Dong-Qing,&Gou Qing-Quan.(2010).Surface Corrugation in Rotational and Diffractive Scattering of O-2 from LiF (001).COMMUNICATIONS IN THEORETICAL PHYSICS,54(6),1112-1120.
MLA	Xu Kai,et al."Surface Corrugation in Rotational and Diffractive Scattering of O-2 from LiF (001)".COMMUNICATIONS IN THEORETICAL PHYSICS 54.6(2010):1112-1120.