Spin-component scaled second-order Møller-Plesset perturbation theory for the calculation of molecular geometries and harmonic vibrational frequencies

Chemical Physics Letters

Volumn 392, Issue 1-3, 2004, Pages 229-235

  Gerenkamp, Mareike ^a   Grimme, Stefan ^a  

^a UNIVERSITY OF MÜNSTER   (Germany)

Author keywords

[No Author keywords available]

Indexed keywords

ACCELERATION; ANALYTICAL ERROR; ARTICLE; CHEMICAL BOND; EXPERIMENTAL TEST; GEOMETRY; MATHEMATICAL COMPUTING; MOLECULAR DYNAMICS; MOLECULAR INTERACTION; MOLECULAR MECHANICS; PHASE TRANSITION; REACTION ANALYSIS; STATISTICAL SIGNIFICANCE; SYSTEM ANALYSIS; TECHNIQUE; THEORY; VIBRATION;

EID: 2942657242     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cplett.2004.05.063     Document Type: Article

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