The structure, vibrational spectra and nonlinear optical properties of the l-lysine × tartaric acid complex-Theoretical studies

Spectrochimica Acta - Part A: Molecular and Biomolecular Spectroscopy

Volumn 64, Issue 1, 2006, Pages 6-23

  Drozd, M ^a   Marchewka, M K ^a  

^a INSTITUTE OF LOW TEMPERATURE AND STRUCTURE RESEARCH   (Poland)

Author keywords

B3LYP; DFT; Hydrogen bond; l Lysine; Nonlinear optics; PED; RHF; Tartaric acid; Time dependent HF

Indexed keywords

CRYSTALLOGRAPHY; HYDROGEN BONDS; INFRARED SPECTROSCOPY; X RAY ANALYSIS;

B3LYP; DFT; HYPERPOLARIZABILITY; L-LYSINE; POTENTIAL ENERGY DISTRIBUTION (OED); RESTRICTED HARTEE-FOCK (RHF); TARTARIC ACID; TIME-DEPENDENT HF; VIBRATIONAL SPECTRA;

NONLINEAR OPTICS;

CARBON; HYDROGEN; LYSINE; NITROGEN; OXYGEN; TARTARIC ACID; TARTARIC ACID DERIVATIVE;

ARTICLE; CHEMISTRY; CONFORMATION; HYDROGEN BOND; INFRARED SPECTROSCOPY; OPTICS; X RAY CRYSTALLOGRAPHY;

CARBON; CRYSTALLOGRAPHY, X-RAY; HYDROGEN; HYDROGEN BONDING; LYSINE; MOLECULAR CONFORMATION; NITROGEN; OPTICS; OXYGEN; SPECTROSCOPY, FOURIER TRANSFORM INFRARED; TARTRATES;

EID: 33645988213     PISSN: 13861425     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.saa.2005.06.033     Document Type: Article

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