Theoretical screening of -NH2-, -OH-, -CH 3-, -F- and -SH-Substituted porphyrins as sensitizer candidates for dye-sensitized solar cells

Journal of Physical Chemistry A

Volumn 114, Issue 4, 2010, Pages 1973-1979

  Ruimin, Ma ^a   Guo, Ping ^a   Yang, Linlin ^a   Guo, Lianshun ^a   Zhang, Xianxi ^a,b   Nazeeruddin, Mohammad K ^b   Grätzel, Michael ^b  

^a LIAOCHENG UNIVERSITY   (China)

^b EPFL   (Switzerland)

Author keywords

[No Author keywords available]

Indexed keywords

ABSORPTION BAND; DENSITY FUNCTIONALS; DONOR-ACCEPTOR COMBINATIONS; DYE-SENSITIZED SOLAR CELL; FRONTIER MOLECULAR ORBITALS; HOMO-LUMO GAPS; PHOTON-TO-CURRENT CONVERSION EFFICIENCY; PORPHINE; RED-SHIFTED; SPATIAL DISTRIBUTION;

CONVERSION EFFICIENCY; MOLECULAR ORBITALS; SOLAR CELLS;

PORPHYRINS;

EID: 76049104371     PISSN: 10895639     EISSN: 15205215     Source Type: Journal    
DOI: 10.1021/jp909787t     Document Type: Article

References (20)

1. O'Regan, B.; Grätzel, M. Nature 1991, 353, 737.
2. Hagfledt, A.; Grätzel, M. Acc. Chem. Res. 2000, 33, 269.
3. Grätzel, M. Nature 2001, 414, 338.
4. Robertson, N. Angew. Chem., Int. Ed. 2006, 45, 2-10.
5. Hamann, T. W.; Jensen, R. A.; Martinson, A. B. F.; Ryswyk, H. V.; Hupp, J. T. Enrrgy Environ. Sci. 2008, 1, 66-78.
6. Nazeeruddin, Md. K.; De Angelis, F.; Fantacci, S.; Selloni, A.; Viscardi, G.; Liska, P.; Ito, S.; Takeru, B.; Gratzel, M. J. Am. Chem. Soc. 2005, 127, 16835.
7. Grätzel, M. J. Photochem. Photobiol. C 2003, 4, 145-153.
8. Mizuseki, H.; Niimura, K.; Majumder, C.; et al. Mol. Cryst. Liq. Cryst. 2003, 406, 11/[205].
9. Wämser, C. C.; Kim, H.-S.; Lee, J.-K. Opt. Mater. 2002, 21, 221.
10. Kroeze, J. E.; Savenije, T. J.; Warman, J. M. J. Photochem. Photobiol. A 2002, 148, 49.
11. Rai, S.; Ravikan, M. Tetrahedron 2007, 63, 2455.
12. Flamigni, L.; Ventura, B.; Tasior, M.; Gryko, D. T. Inorg. Chim. Acta 2007, 360, 803.
13. Wienke, J.; Schaafsma, T. J. J. Phys. Chem. B 1999, 103, 2702.
14. Nazeeruddin, Md. K.; Humphry-Baker, R.; Officer, D. L.; Campbell, W. M.; Burrel, A. K.; Gratzel, M. Langmuir 2004, 20, 6514-6517.
15. Campbell, W. M.; Burrell, A. K.; Officer, D. L.; Jolley, K. W. Coord. Chem. Rev. 2004, 248, 1363-1379.
16. Wang, Q.; Campbell, W. M.; Bonfantani, E. E.; Jolley, K. W.; Officer, D. L.; Walsh, P. J.; Gordon, K.; Humphry-Baker, R.; Nazeeruddin, Md. K.; Gratzel, M. J. Phys. Chem. B 2005, 109, 15397.
17. Campbell, W. M.; Jolley, K. W.; Wagner, P.; Wagner, K.; Walsh, P. J.; Gordon, K. C.; Schmidt-Mende, L.; Nazeeruddin, Md. K.; Wang, Q.; Gratzel, M.; Officer, D. L. J. Phys. Chem. C 2007, 111, 11760.
18. Ma, R.; Guo, P.; Cui, H.; Zhang, X.; Nazeeruddin, Md. K.; Grätzel, M. J. Phys. Chem. A 2009, 113, 10119-10124.
19. Balanay, M. P.; Dipaling, C. V. P.; Lee, S. H.; Kim, D. H.; Lee, K. H. Sol. Energy Mater. Sol. Cells 2007, 91, 1775-1781.
20. Frisch M. J. Gaussian'03, revision B.05; Gaussian, Inc.: Pittsburgh, PA, 2003.