Investigation of NLO properties of substituted (M)-tetrathia-[7]-helicenes by semiempirical and DFT methods

International Journal of Quantum Chemistry

Volumn 91, Issue 3 SPEC, 2003, Pages 297-302

  Daul, Claude A ^a   Ciofini, Ilaria ^b   Weber, Valery ^a  

^a UNIVERSITY OF FRIBOURG   (Switzerland)

^b UNIVERSITY OF WÜRZBURG   (Germany)

Author keywords

Ab initio methods; Helicene; Nonlinear optics; Polarizability; Semiempirical methods

Indexed keywords

ELECTRIC PROPERTIES; MOLECULES; NONLINEAR OPTICS; OPTICAL MATERIALS; OPTICAL PROPERTIES; POLARIZATION; PROBABILITY DENSITY FUNCTION;

FIRST HYPERPOLARIZABILITY; NONLINEAR OPTICAL PROPERTIES; SEMIEMPIRICAL METHODS; STATIC AND DYNAMIC POLARIZABILITY; TETRATHIA HELICENES;

AROMATIC COMPOUNDS;

EID: 0037454934     PISSN: 00207608     EISSN: None     Source Type: Journal    
DOI: 10.1002/qua.10444     Document Type: Article

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