Configuration interaction study of electronic structures of CdCl including spin-orbit coupling

CORC > 长春光学精密机械与物理研究所 > 中国科学院长春光学精密机械与物理研究所 > 中科院长春光机所知识产出

	Configuration interaction study of electronic structures of CdCl including spin-orbit coupling
	Zhao, S.; J. Cui; R. Li and B. Yan
刊名	Chemical Physics Letters
	2017
卷号	677
英文摘要	Adiabatic potential energy curves (PECs) and the dipole moments (DMs) for the 14 low-lying -S states of CdCl were computed at configuration interaction method including Davidson correction (+Q). To quantitatively evaluate the spin-orbit coupling (SOC) effect, the SOC integrals involving the X2+and 22+were investigated. The spectroscopic constants of 9 bound -S states and 4 lowest bound states were derived. Moreover, the radiative lifetimes of the vibrational levels of bound states were predicted for the first time. Finally, the feasibility and challenges of laser cooling of CdCl were discussed based on a three-laser cooling scheme. 2017 Elsevier B.V.
语种	英语
内容类型	期刊论文
源URL	[http://ir.ciomp.ac.cn/handle/181722/59476]
专题	长春光学精密机械与物理研究所_中科院长春光机所知识产出
推荐引用方式 GB/T 7714	Zhao, S.,J. Cui,R. Li and B. Yan. Configuration interaction study of electronic structures of CdCl including spin-orbit coupling[J]. Chemical Physics Letters,2017,677.
APA	Zhao, S.,J. Cui,&R. Li and B. Yan.(2017).Configuration interaction study of electronic structures of CdCl including spin-orbit coupling.Chemical Physics Letters,677.
MLA	Zhao, S.,et al."Configuration interaction study of electronic structures of CdCl including spin-orbit coupling".Chemical Physics Letters 677(2017).