Thermodynamics of Hydrogen Bonding from Molecular Orbital Theory: 1. Water

AIChE Journal

Volumn 43, Issue 6, 1997, Pages 1589-1596

  Wolbach, Jeffrey P ^a   Sandler, Stanley I ^a  

^a University of Delaware   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTATIONAL METHODS; ENTHALPY; ENTROPY; HYDROGEN BONDS; MIXTURES; PARAMETER ESTIMATION; PROBABILITY DENSITY FUNCTION;

DENSITY FUNCTIONAL THEORY; HARTREE-FOCK METHODS; MOLECULAR ORBITAL THEORY;

WATER;

EID: 0031168143     PISSN: 00011541     EISSN: None     Source Type: Journal    
DOI: 10.1002/aic.690430622     Document Type: Article

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