Calculations of optical rotation from density functional theory

Chinese Physics Letters

Volumn 24, Issue 5, 2007, Pages 1207-1209

  Neto, Antônio Canal ^a   Jorge, Francisco Elias ^a  

^a FEDERAL UNIVERSITY OF ESPÍRITO SANTO   (Brazil)

Author keywords

[No Author keywords available]

Indexed keywords

OPTICAL MATERIALS; OPTICAL ROTATION; QUANTUM CHEMISTRY; STEREOCHEMISTRY;

ATOMIC ORBITAL; BASIS SETS; CHIRAL MOLECULE; D LINES; DENSITY FUNCTION THEORY CALCULATIONS; DENSITY-FUNCTIONAL-THEORY; FREQUENCY-DEPENDENT; FUNCTIONALS; INDEPENDENT VALUES; LINE FREQUENCY;

DENSITY FUNCTIONAL THEORY;

EID: 34249288287     PISSN: 0256307X     EISSN: 17413540     Source Type: Journal    
DOI: 10.1088/0256-307X/24/5/022     Document Type: Article

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