A decomposition of the total energy at the HF-SCF and at several levels of correlation II. A study of the interaction of (H2O)2 and (HF)2 systems

Journal of Molecular Structure: THEOCHEM

Volumn 422, Issue 1-3, 1998, Pages 143-151

  Kapuy, E ^a   Kozmutza, C ^b   Ovari L ^c  

^a UNIVERSITY OF SZEGED   (Hungary)

^b BUDAPEST UNIVERSITY OF TECHNOLOGY AND ECONOMICS   (Hungary)

^c INSTITUTE OF EXPERIMENTAL MEDICINE   (Hungary)

Author keywords

Energy decomposition; Separated molecular orbitals

Indexed keywords

EID: 0042856373     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0166-1280(97)00104-8     Document Type: Article

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