Molecular and electronic structures of black dye; an efficient sensitizing dye for nanocrystalline TiO2 solar cells

Journal of Molecular Structure

Volumn 658, Issue 1-2, 2003, Pages 25-32

  Aiga, Fumihiko ^a   Tada, Tsukasa ^a  

^a TOSHIBA CORPORATION   (Japan)

Author keywords

Density functional theory; Electron transfer; Excited state; Sensitizing dye; Solar cell

Indexed keywords

DYE; IODIDE; LIGAND; PYRIDINE DERIVATIVE; SULFUR; TERPYRIDINE LIGAND; TITANIUM DIOXIDE; UNCLASSIFIED DRUG;

ARTICLE; CRYSTAL STRUCTURE; DENSITY; DENSITY FUNCTIONAL THEORY; ELECTRON TRANSPORT; MOLECULAR MECHANICS; NANOPARTICLE; OXIDATION REDUCTION REACTION; SENSITIZATION; SOLAR CELL; SOLAR ENERGY; STRUCTURE ANALYSIS;

EID: 0042335888     PISSN: 00222860     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0022-2860(03)00408-3     Document Type: Article

References (33)

1. B. O'Regan, M. Gr̈atzel, Nautre 353 (1991) 737.
2. K. Kalyanasundaram, M. Gr̈atzel, Coord. Chem. Rev. 77 (1998) 347.
3. A. Hagfeldt, M. Gr̈atzel, Acc. Chem. Res. 33 (2000) 269.
4. M.K. Nazeeruddin, A. Kay, I. Rodicio, R. Humphry-Baker, E. Müller, P. Liska, N. Vlachopoulos, M. Gr̈atzel, J. Am. Chem. Soc. 115 (1993) 6382.
5. O. Kohle, S. Ruile, M. Gr̈atzel, Inorg. Chem. 35 (1996) 4779.
6. U. Bach, D. Lupo, P. Comte, J.E. Moser, F. Weissortel, J. Salbeck, H. Spreitzler, M. Gr̈aetzel, Nature 395 (1998) 583.
7. M.K. Nazzeruddin, P. Pécy, M. Gr̈atzel, Chem. Commun. (1997) 1705.
8. M.K. Nazzeruddin, P. Pécy, T. Renouard, S.M. Zakeeruddin, R. Humphry-Baker, P. Comte, P. Liska, L. Cevey, E. Costa, V. Shklover, L. Spiccia, G.B. Deacon, C.A. Bignozzi, M. Gr̈atzel, J. Am. Chem. Soc. (2001) 123.
9. C. Bauer, G. Boschloo, E. Mukhtar, A. Hagfeldt, J. Phys. Chem. B 106 (2002) 12693.
10. K.S. Finnie, J.R. Bartlett, J.L. Woolfrey, Langmuir 14 (1998) 2744.
11. R. Argazzi, C.A. Bignozzi, G.M. Hasselmann, G.J. Meyer, Inorg. Chem. 37 (1998) 4533.
12. S. Ferrere, B.A. Gregg, J. Am. Chem. Soc. 120 (1998) 843.
13. R. Amadelli, R. Argazzi, C.A. Bignozzi, F. Scandola, J. Am. Chem. Soc. 112 (1990) 7099.
14. M.K. Nazeeruddin, P. Liska, J. Moser, N. Vlachopoulos, M. Gr̈atzel, Helv. Chim. Acta 73 (1990) 1788.
15. O. Enea, J. Moser, M. Gr̈atzel, J. Electroanal. Chem. 259 (1989) 59.
16. A. Kay, M. Gr̈atzel, J. Phys. Chem. 97 (1993) 6272.
17. A. Kay, R. Humphry-Baker, M. Gr̈atzel, J. Phys. Chem. 98 (1994) 952.
18. Md.K. Nazeeruddin, R. Humphry-Baker, M. Gr̈atzel, B.A. Murrer, Chem. Commun. (1998) 719.
19. H. Suguhara, L.P. Singh, K. Sayama, H. Arakawa, Md. K. Nazeeruddin, M. Gr̈atzel, Chem. Lett. (1998) 1005.
20. K. Sayama, M. Sugino, H. Sugihara, Y. Abe, H. Arakawa, Chem. Lett. (1998) 753.
21. A. Broo, P. Lincoln, Inorg. Chem. 36 (1997) 2544.
22. S.I. Gorelsky, E.S. Dodsworth, A.B.P. Lever, A.A. Vlcek, Coord. Chem. Rev. 174 (1998) 469.
23. K. Srikanth, V.R. Marathe, M.J. Mishra, Int. J. Quantum. Chem. 89 (2002) 535.
24. C. Daul, E.J. Baerends, P. Vemooijs, Inorg. Chem. 33 (1994) 3538.
25. R. Åkesson, L.G.M. Pettrtson, M. Sandstr̈om, J. Wahlgren, J. Am. Chem. Soc. 116 (1994) 8691.
26. A. Broo, Int. J. Quantum Chem. Symp. 30 (1996) 119.
27. J.E. Monat, J.H. Rodriguez, J.K. McCusker, J. Phys. Chem. A 106 (2002) 7399.
28. J-F. Guillemoles, V. Barone, L. Joubert, C. Adamo, J. Phys. Chem. A 106 (2002) 11354.
29. R. Bauernschmitt, R. Ahlrichs, Chem. Phys. Lett. 256 (1996) 454.
30. C. Adamo, G.E. Scuseria, V. Barone, J. Chem. Phys. 111 (1999) 2889.
31. M.J. Frisch, G.W. Trucks, H.B. Schlegel, G.E. Scuseria, M.A. Robb, J.R. Cheeseman, V.G. Zakrzewski, J.A. Montgomery, Jr., R.E. Stratmann, J.C. Burant, S. Dapprich, J.M. Millam, A.D. Daniels, K.N. Kudin, M.C. Strain, O. Farkas, J. Tomasi, V. Barone, M. Cossi, R. Cammi, B. Mennucci, C. Pomelli, C. Adamo, S. Clifford, J. Ochterski, G.A. Petersson, P.Y. Ayala, Q. Cui, K. Morokuma, P. Salvador, J.J. Dannenberg, D.K. Malick, A.D. Rabuck, K. Raghavachari, J.B. Foresman, J. Cioslowski, J.V. Ortiz, A.G. Baboul, B.B. Stefanov, G. Liu, A. Liashenko, P. Piskorz, I. Komaromi, R. Gomperts, R.L. Martin, D.J. Fox, T. Keith, M.A. Al-Laham, C.Y. Peng, A. Nanayakkara, M. Challacombe, P.M.W. Gill, B. Johnson, W. Chen, M.W. Wong, J.L. Andres, C. Gonzalez, M. Head-Gordon, E.S. Replogle, J.A. Pople, GAUSSIAN 98, Revision A.10, Gaussian, Inc., Pittsburgh PA, 2001.
32. G.A. Crosby, R.G. Highland, K.A. Truesdell, Coord. Chem. Rev. 64 (1985) 41.
33. R.A. Marcus, N. Sutin, Biochim. Biophys. Acta 811 (1985) 265.