Time-dependent density functional theory applied to ligand-field excitations and their circular dichroism in some transition metal complexes

Chemical Physics

Volumn 391, Issue 1, 2011, Pages 92-100

  Rudolph, Mark ^a   Ziegler, Tom ^b   Autschbach, Jochen ^a  

^a UNIVERSITY AT BUFFALO   (United States)

^b UNIVERSITY OF CALGARY   (Canada)

Author keywords

Circular dichroism; Excitation spectra; Metal complexes; Time dependent density functional theory

Indexed keywords

EID: 82255186523     PISSN: 03010104     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.chemphys.2011.03.022     Document Type: Article

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