Vapor pressure isotope effects of water studied by molecular orbital calculations

Journal of Nuclear Science and Technology

Volumn 40, Issue 7, 2003, Pages 517-523

  Oi, Takao ^a  

^a SOPHIA UNIVERSITY   (Japan)

Author keywords

B3LYP 6 311G(d); Fractionation factor; HF 6 31G(d); Hydrogen bonds; Molecular orbital calculations; Reduced partition function ratios; Vapor pressure isotope effects; Water; Water cluster

Indexed keywords

FRACTIONATION; HYDROGEN BONDS; ISOTOPES; MOLECULAR VIBRATIONS; NUCLEAR PHYSICS; VAPOR PRESSURE; WATER;

MOLECULAR ORBITALS (MO);

MOLECULAR PHYSICS;

EID: 0042921304     PISSN: 00223131     EISSN: None     Source Type: Journal    
DOI: 10.1080/18811248.2003.9715386     Document Type: Article

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