Density functional studies of conformational properties of conjugated systems containing heteroatoms

Journal of Molecular Structure: THEOCHEM

Volumn 393, Issue 1-3 SPEC. ISS., 1997, Pages 39-58

  Mannfors, B ^a   Koskinen, J T ^a   Pietila L O ^b   Ahjopalo, L ^b  

^a UNIVERSITY OF HELSINKI   (Finland)

^b VTT TECHNICAL RESEARCH CENTRE OF FINLAND   (Finland)

Author keywords

Conformational property; Conjugated molecules; Density functional method; Molecular modelling

Indexed keywords

EID: 0001773992     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/s0166-1280(96)04979-2     Document Type: Article

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