Intramolecular charge transfer and hydrogen bonding interactions of nonlinear optical material N-benzoyl glycine: Vibrational spectral study

Vibrational Spectroscopy

Volumn 54, Issue 1, 2010, Pages 72-80

  Sajan, D ^a,d   Ravindra, H J ^b   Misra, Neeraj ^c   Joe, I Hubert ^d  

^a BISHOP MOORE COLLEGE   (India)

^b Srinivas School of Engineering   (India)

^c UNIVERSITY OF LUCKNOW   (India)

^d MAR IVANIOS COLLEGE   (India)

Author keywords

Density functional theory; FT IR; Intramolecular charge transfer (ICT); NIR FT Raman

Indexed keywords

CHARGED SPECIES; DENSITY FUNCTIONALS; ELECTRON PHONON COUPLINGS; EQUILIBRIUM GEOMETRIES; FIRST HYPERPOLARIZABILITIES; FT-IR; HYDROGEN BONDING INTERACTIONS; HYDROGEN BONDINGS; INTRA-MOLECULAR CHARGE TRANSFER; INTRAMOLECULAR CHARGE TRANSFERS; IONIC GROUND STATE; NEAR INFRARED; NIR-FT RAMAN; NON-CENTROSYMMETRIC; NON-LINEAR OPTICAL MATERIAL; NONBONDED INTERACTION; SPECTRAL FEATURE; SPECTRAL STUDIES; TWISTED INTRA-MOLECULAR CHARGE TRANSFERS; VIBRATIONAL WAVENUMBERS; WAVE NUMBERS;

CHARGE TRANSFER; CRYSTAL STRUCTURE; FOURIER TRANSFORMS; HYDROGEN; HYDROGEN BONDS; INFRARED DEVICES; ION EXCHANGE; MASS TRANSFER; MATHEMATICAL TRANSFORMATIONS; OPTICAL MATERIALS; PHONONS; SPECTROSCOPIC ANALYSIS; VIBRATION ANALYSIS;

DENSITY FUNCTIONAL THEORY;

EID: 77955718097     PISSN: 09242031     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.vibspec.2010.06.007     Document Type: Article

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