Spin-orbit all-electron configuration interaction study on the electronic structure and radiative lifetimes of low-lying excited states of CdH

被引:9
作者
Li, Rui [1 ,2 ]
Zhai, Zhen [3 ]
Zhang, Xiaomei [1 ]
Jin, Mingxing [1 ]
Xu, Haifeng [1 ]
Yan, Bing [1 ]
机构
[1] Jilin Univ, Inst Atom & Mol Phys, Changchun 130012, Peoples R China
[2] Qiqihar Univ, Dept Phys, Coll Sci, Qiqihar 161006, Peoples R China
[3] Chinese Acad Sci, Beijing Natl Lab Condensed Matter Phys, Inst Phys, Lab Opt Phys, Beijing 100190, Peoples R China
基金
中国国家自然科学基金;
关键词
BAND-SPECTRUM STRUCTURE; DIATOMIC-MOLECULES; INFRARED-SPECTRA; CADMIUM; ZNH; TRANSITIONS; ZINC;
D O I
10.1016/j.cplett.2014.03.017
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
We calculated the potential energy curves of 10 Lambda-S states correlated with the five lowest dissociation limits of the CdH radical by a configuration interaction method, as well as those of 17 Omega states generated from the Lambda-S states. The spectroscopic parameters of bound states were calculated and found to be well consistent with the latest experimental results. We also discussed the possible predissociation mechanisms of C-2 Sigma(+), 4(2)Sigma(+) and 2(2)Pi states on the basis of the calculation of spin-orbit elements. Finally, the allowed transition dipole moments and the radiative lifetimes of A(2)Pi, B-2 Sigma(+) and C-2 Sigma(+) states were obtained. (C) 2014 Elsevier B. V. All rights reserved.
引用
收藏
页码:51 / 56
页数:6
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