Influence of diffuse and polarization functions on the second-order Møller-Plesset optimized dihedral angle of biphenyl

Theoretical Chemistry Accounts

Volumn 109, Issue 5, 2003, Pages 274-277

  Grein, Friedrich ^a  

^a UNIVERSITY OF NEW BRUNSWICK   (Canada)

Author keywords

Biphenyl; Diffuse functions; Dihedral angle; Polarization functions; Second order M ller Plesset method

Indexed keywords

BIPHENYL;

ARTICLE; CALCULATION; CONFORMATION; POLARIZATION; THEORY;

EID: 0038640856     PISSN: 1432881X     EISSN: None     Source Type: Journal    
DOI: 10.1007/s00214-003-0429-3     Document Type: Article

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