A Circle Has No End: Role of Cyclic Topology and Accompanying Structural Reorganization on the Hole Distribution in Cyclic and Linear Poly-p-phenylene Molecular Wires

Journal of the American Chemical Society

Volumn 137, Issue 47, 2015, Pages 14999-15006

  Talipov, Marat R ^a   Jasti, Ramesh ^b   Rathore, Rajendra ^a  

^a Marquette University   (United States)

^b UNIVERSITY OF OREGON   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

AROMATIC COMPOUNDS; CHARGE TRANSFER; FUNCTIONAL MATERIALS; OPTICAL PROPERTIES; POSITIVE IONS;

CONCOMITANT EFFECTS; ELECTRONIC COUPLING ELEMENTS; GEOMETRICAL DISTORTION; HOLE DISTRIBUTION; OXIDATION POTENTIALS; PHOTOVOLTAIC APPLICATIONS; PI-CONJUGATED SYSTEM; STRUCTURAL REORGANIZATION;

TOPOLOGY;

BENZENE; MONOMER; NANOWIRE; OLIGOMER; PHENAZONE DERIVATIVE; POLYMER; POLYPHENYLENE SULFIDE;

ACCELERATION; ARTICLE; CHEMICAL STRUCTURE; DENSITY FUNCTIONAL THEORY; EXCITATION; MOLECULAR ELECTRONICS; OXIDATION REDUCTION POTENTIAL; CHEMISTRY;

MODELS, MOLECULAR; MOLECULAR STRUCTURE; POLYMERS;

EID: 84948700518     PISSN: 00027863     EISSN: 15205126     Source Type: Journal    
DOI: 10.1021/jacs.5b09596     Document Type: Article

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