Effect of self-consistency and electron correlation on the spatial extension of bipolaronic defects

Organic Electronics

Volumn 5, Issue 4, 2004, Pages 167-174

  Niehaus, T A ^a   Di Carlo, A ^b   Frauenheim, Th ^a  

^a UNIVERSITY OF PADERBORN   (Germany)

^b UNIVERSITY OF ROME TOR VERGATA   (Italy)

Author keywords

Bipolaron; Charge transport; Density functional theory; Polythiophene and derivatives

Indexed keywords

CHARGE TRANSFER; DERIVATIVES; ELECTRIC EXCITATION; HAMILTONIANS; MOLECULAR DYNAMICS; OLIGOMERS; PROBABILITY DENSITY FUNCTION; PROBLEM SOLVING;

BIPOLARON; CHARGE-TRANSPORT; POLYTHIOPHENE AND DERIVATIVES;

ELECTRONIC STRUCTURE;

EID: 2442551909     PISSN: 15661199     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.orgel.2003.11.001     Document Type: Article

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