New theoretical studies on the dihedral angle and energy barriers of biphenyl

Journal of Molecular Structure: THEOCHEM

Volumn 624, Issue 1-3, 2003, Pages 23-28

  Grein, Friedrich ^a  

^a UNIVERSITY OF NEW BRUNSWICK   (Canada)

Author keywords

Biphenyl; Density functional methods; Dihedral angle; Energy barriers; Hartree Fock method; M ller method

Indexed keywords

BIPHENYL DERIVATIVE;

ARTICLE; CONFORMATION; ENERGY; GEOMETRY; MOLECULAR DYNAMICS; POLARIZATION; THEORETICAL STUDY;

EID: 0037466295     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0166-1280(02)00590-0     Document Type: Article

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