Improving ab initio infrared spectra of glucose-water complexes by considering explicit intermolecular hydrogen bonds

Journal of Chemical Physics

Volumn 119, Issue 19, 2003, Pages 10133-10137

  Suzuki, Teppei ^a   Sota, Takayuki ^a  

^a WASEDA UNIVERSITY   (Japan)

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTATIONAL METHODS; COMPUTER SIMULATION; ELECTROSTATICS; GLUCOSE; INFRARED SPECTROSCOPY; MOLECULAR VIBRATIONS; PERMITTIVITY; PROBABILITY DENSITY FUNCTION; SOLUTIONS; WATER;

DENSITY FUNCTIONAL THEORY; INTERMOLECULAR HYDROGEN BONDS; POLYATOMIC MOLECULES; SOLVATION;

HYDROGEN BONDS;

EID: 0345529857     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.1619953     Document Type: Article

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