Calculating the second-order nonlinear optical susceptibilities of 3-methyl-4-nitropyridine N-oxide, 2-carboxylic acid-4-nitropyridine-1-oxide, 2-methyl-4-nitroaniline, and m-nitroaniline crystals

International Journal of Quantum Chemistry

Volumn 111, Issue 4, 2011, Pages 880-890

  Kanoun, Mohammed Benali ^a   Champagne, Benoît ^a  

^a UNIVERSITY OF NAMUR   (Belgium)

Author keywords

electrostatic interaction scheme; first hyperpolarizabilities; molecular crystals; nonlinear optics; second order nonlinear optical susceptibilities

Indexed keywords

AB INITIO; CRYSTAL PACKINGS; ELECTROSTATIC INTERACTIONS; EXPERIMENTAL DATA; FIRST HYPERPOLARIZABILITIES; FREQUENCY DISPERSION; MOLECULAR POLARIZABILITIES; MOLECULAR PROPERTIES; MOLECULAR RESPONSE; NITROANILINES; NITROPYRIDINE; RELATIVE AMPLITUDE; SECOND HARMONIC GENERATION; SECOND-ORDER NONLINEAR OPTICAL; SECOND-ORDER NONLINEAR SUSCEPTIBILITY;

ANILINE; CARBOXYLIC ACIDS; ELECTROSTATIC SEPARATORS; ELECTROSTATICS; HARMONIC GENERATION; MOLECULAR CRYSTALS; NITROGEN COMPOUNDS; OPTICAL MATERIALS;

NONLINEAR OPTICS;

EID: 78650593089     PISSN: 00207608     EISSN: 1097461X     Source Type: Journal    
DOI: 10.1002/qua.22852     Document Type: Article

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