Combining spin-adapted open-shell TD-DFT with spin-orbit coupling

Molecular Physics

Volumn 111, Issue 24, 2013, Pages 3741-3755

  Li, Zhendong ^a   Suo, Bingbing ^a   Zhang, Yong ^a   Xiao, Yunlong ^a   Liu, Wenjian ^a  

^a PEKING UNIVERSITY   (China)

Author keywords

fine structure; open shell systems; spin adapted TD DFT; spin free X2C; spin orbit coupling

Indexed keywords

FINE STRUCTURES; OPEN-SHELL SYSTEMS; SPIN-ADAPTED TD-DFT; SPIN-FREE X2C; SPIN-ORBIT COUPLINGS;

CHEMICAL ELEMENTS; EXCITED STATES; HAMILTONIANS; HIGH ENERGY PHYSICS; MAGNETIC MOMENTS; SHELLS (STRUCTURES);

ELECTROSPINNING;

EID: 84890150394     PISSN: 00268976     EISSN: 13623028     Source Type: Journal    
DOI: 10.1080/00268976.2013.785611     Document Type: Article

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