Analytical one-particle approach to the π electronic structure of heterocyclic polymers

Journal of Chemical Physics

Volumn 107, Issue 13, 1997, Pages 5032-5050

  Onipko, Alexander ^a   Klymenko, Yuriy ^b   Malysheva, Lyuba ^c  

^a LINKÖPING UNIVERSITY   (Sweden)

^b Space Research Institute ^*  (Ukraine)

^c BOGOLYUBOV INSTITUTE FOR THEORETICAL PHYSICS   (Ukraine)

Author keywords

[No Author keywords available]

Indexed keywords

BAND STRUCTURE; CARBON; ELECTRON ENERGY LEVELS; ELECTRONS; GREEN'S FUNCTION; MATHEMATICAL MODELS; MONOMERS; OLIGOMERS; POLYMERS;

BAND DEGENERACY; BAND GAPS; BAND SPECTRUM; HETEROATOM; HETEROCYCLE; HETEROCYCLIC POLYMERS; HIGHEST OCCUPIED MOLECULAR ORBITAL; LOWEST UNOCCUPIED MOLECULAR ORBITAL;

ELECTRONIC STRUCTURE;

EID: 0031256438     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.474867     Document Type: Article

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51. In this presentation a number of interesting mathematical details have been omitted for the sake of brevity. These can be provided by the authors on request.