Ab initio potential and dipole moment surfaces for water. II. Local-monomer calculations of the infrared spectra of water clusters

Journal of Chemical Physics

Volumn 134, Issue 15, 2011, Pages

  Wang, Yimin ^a   Bowman, Joel M ^a  

^a EMORY UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

AB INITIO; BENCHMARK CALCULATIONS; DIPOLE MOMENT SURFACES; EMPIRICAL POTENTIALS; FULLY-COUPLED; INFRARED SPECTRUM; IR SPECTRUM; NORMAL MODE ANALYSIS; QUANTUM APPROACH; SCHRDINGER EQUATIONS; WATER CLUSTER; WATER DIMERS;

DIMERS; MONOMERS; SPECTROSCOPY;

CALCULATIONS;

EID: 79955445837     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3579995     Document Type: Article

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