Theoretical design of fullerene derivatives as electron acceptors for bulk heterojunction solar cells
Autor: | Bobeico, Eugenia, Morvillo, P |
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Jazyk: | angličtina |
Rok vydání: | 2009 |
Předmět: | |
Zdroj: | Moldavian Journal of the Physical Sciences, Vol 8, Iss 2, Pp 250-255 (2009) |
Druh dokumentu: | article |
ISSN: | 2537-6365 1810-648X |
Popis: | In this paper semiempirical quantum chemical methods were used to optimize the ge- ometry and to calculate the LUMO level of different fullerene derivatives used as electron acceptors in bulk heterojunction solar cells. The calculated LUMO levels were successfully correlated with the open circuit voltage of devices realized using poly[2-methoxy-5-(3,7- dimethyloctyloxy)]–1,4-phenylenevinylene as electron donor, showing the possibility to use a theoretical approach to design new acceptor molecules. |
Databáze: | Directory of Open Access Journals |
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