Computational approaches to charge transfer excitations in a zinc tetraphenylporphyrin and C70 complex

Journal of Chemical Physics

Volumn 132, Issue 10, 2010, Pages

  Ghosh, Prasenjit ^a   Gebauer, Ralph ^a,b  

^a ABDUS SALAM INTERNATIONAL CENTRE FOR THEORETICAL PHYSICS   (Italy)

^b DEMOCRITOS NATIONAL SIMULATION CENTER   (Italy)

Author keywords

[No Author keywords available]

Indexed keywords

C70 FULLERENES; CHARGE TRANSFER ENERGY; CHARGE-TRANSFER EXCITATIONS; COMPUTATIONAL APPROACH; DONOR-ACCEPTOR DYADS; ELECTRONIC CHARGES; NANO-STRUCTURED; PHOTOVOLTAIC MATERIALS; QUANTITATIVE ESTIMATES; TIME-DEPENDENT DFT; ZINC TETRAPHENYLPORPHYRIN; ZINC-PORPHYRIN;

CHARGE TRANSFER; ION EXCHANGE; MASS TRANSFER; PORPHYRINS; PROBABILITY DENSITY FUNCTION; ZINC; ZINC COMPOUNDS;

DENSITY FUNCTIONAL THEORY;

EID: 77949631605     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3326226     Document Type: Article

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