Modeling the structural and electronic properties of an optically active regioregular polythiophene

Journal of Physical Chemistry C

Volumn 114, Issue 25, 2010, Pages 11074-11080

  Bertran, Oscar ^a   Torras, Juan ^a   Alemán, Carlos ^a  

^a UNIVERSITAT POLITÈCNICA DE CATALUNYA   (Spain)

Author keywords

[No Author keywords available]

Indexed keywords

DENSITY FUNCTIONAL THEORY; ELECTRONIC PROPERTIES; FUNCTIONAL POLYMERS; MECHANICAL PROPERTIES; OLIGOMERS; ORGANIC POLYMERS; QUANTUM THEORY; THIOPHENE; ULTRAVIOLET SPECTROSCOPY;

DENSITY FUNCTIONAL THEORY CALCULATIONS; DIHEDRAL ANGLES; EXPERIMENTAL VALUES; HELICAL STRUCTURES; MOLECULAR PROPERTIES; OPTICALLY ACTIVE; PHENYL GROUP; POLY-THIOPHENE; POLYMER CHAINS; QUANTUM-MECHANICAL CALCULATION; REGIO-REGULAR; REPEATING UNIT; STERIC REPULSIONS; SUBSTITUTED POLYTHIOPHENES; THEORETICAL STUDY; TRANSITION ENERGY; UV-VIS SPECTROSCOPY;

CONFORMATIONS;

EID: 84961982761     PISSN: 19327447     EISSN: 19327455     Source Type: Journal    
DOI: 10.1021/jp102223s     Document Type: Article

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