Calculation of the magnetic circular dichroism B term from the imaginary part of the Verdet constant using damped time-dependent density functional theory

Journal of Chemical Physics

Volumn 127, Issue 24, 2007, Pages

  Krykunov, Mykhaylo ^a   Seth, Michael ^a   Ziegler, Tom ^a   Autschbach, Jochen ^b  

^a UNIVERSITY OF CALGARY   (Canada)

^b UNIVERSITY AT BUFFALO   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

DENSITY FUNCTIONAL THEORY; ETHYLENE; MAGNETISM; SPECTRUM ANALYSIS; THIOPHENE;

MAGNETIC CIRCULAR DICHROISM; TIME DEPENDENT DENSITY FUNCTIONAL THEORY (TDDFT);

DICHROISM;

EID: 37549007864     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.2806990     Document Type: Article

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