Molecular geometry and vibrational frequency predictions from the CISD[TQ] wavefunction: The water molecule

Spectrochimica Acta - Part A: Molecular and Biomolecular Spectroscopy

Volumn 53, Issue 8, 1997, Pages 1163-1168

  King, Rollin A ^a   Sherrill, C David ^a   Schaefer III, Henry F ^a  

^a UNIVERSITY OF GEORGIA   (United States)

Author keywords

CISD TQ wavefunction; Molecular geometry; Vibrational frequency; Water molecule

Indexed keywords

EID: 4243733416     PISSN: 13861425     EISSN: None     Source Type: Journal    
DOI: 10.1016/S1386-1425(97)00023-1     Document Type: Article

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