Electron attachment to dye-sensitized solar cell components: Rhodanine and rhodanine-3-acetic acid

Journal of Physical Chemistry C

Volumn 114, Issue 3, 2010, Pages 1725-1732

  Modelli, Alberto ^a,b   Jones, Derek ^c   Pshenichnyuk, Stanislav A ^d  

^a UNIVERSITY OF BOLOGNA   (Italy)

^b Centro Interdipartimentale di Ricerca in Scienze Ambientali (CIRSA)   (Italy)

^c Istituto Per La Sintesi Organica E La Fotoreattività   (Italy)

^d INSTITUTE OF PHYSICS OF MOLECULES AND CRYSTALS   (Russian Federation)

Author keywords

[No Author keywords available]

Indexed keywords

ADIABATIC ELECTRON AFFINITY; ATOMIC REARRANGEMENTS; B3LYP/6-31G; COMPUTATIONAL PROCEDURES; DECAY CHANNELS; DISSOCIATIVE CHANNELS; DISSOCIATIVE ELECTRON ATTACHMENT; DYE-SENSITIZED SOLAR CELL; ELECTRON ATTACHMENT; ELECTRON ENERGIES; ELECTRON TRANSMISSION SPECTROSCOPY; ENERGY RANGES; GASPHASE; HYDROGEN ATOMS; INCIDENT ELECTRONS; MASS FILTER; MOLECULAR ANIONS; MULTIPLE BONDS; NEGATIVE CHARGE; NEUTRAL MOLECULES; ORBITAL ENERGY; RHODANINE; VIRTUAL ORBITALS;

ACETIC ACID; ACIDS; CHEMICAL BONDS; ELECTRON ENERGY LEVELS; ELECTRONS; METAL ANALYSIS; MOLECULES; NEGATIVE IONS; PH EFFECTS; PHOTODISSOCIATION; PHOTOELECTROCHEMICAL CELLS; SOLAR CELLS;

ELECTRON ENERGY LOSS SPECTROSCOPY;

EID: 77249171867     PISSN: 19327447     EISSN: 19327455     Source Type: Journal    
DOI: 10.1021/jp910595v     Document Type: Article

References (52)

1. Aberle, A. G. Thin Solid Films 2009, 517, 4706.
2. Krebs, F. C. Sol. Energy Mater. Sol. Cells 2009, 93, 394.
3. Grätzel, M. Nature 2001, 414, 338.
4. Kamat, P. V.; Schatz, G. C. J. Phys. Chem. C 2009, 113, 15473.
5. Robertson, N. Angew. Chem., Int. Ed. 2006, 45, 2338.
6. Hamann, T. W.; Jensen, R. A.; Martinson, A. B. F.; Van Ryswyk, H.; Hupp, J. T. Energy Environ. Sci. 2008, 1, 66.
7. Segura, J. L.; Martín, N.; Guldi, D. M. Chem. Soc. Rev. 2005, 34, 31.
8. Roquet, S.; Cravino, A.; Leriche, P.; Aléveque, O.; Frère, P.; Roncali, J. J. Am. Chem. Soc. 2006, 128, 3459.
9. Liang, M.; Xu, W.; Cai, F.; Chen, P.; Peng, B.; Chen, J.; Li, Z. J. Phys. Chem. C 2007, 111, 4465.
10. Xu, W.; Peng, B.; Chen, J.; Liang, M.; Cai, F. J. Phys. Chem. C 2008, 112, 874.
11. Cutshall, N. S.; Day, C. O.; Prezhdo, M. Bioorg. Med. Chem. Lett. 2001, 11, 91.
12. Peet, N. P. IDrugs 2000, 3, 131.
13. Sakagami, Y.; Kumeda, Y.; Shibata, M. Biosci., Biotechnol., Biochem. 1998, 62, 1025.
14. Gorishniy, V. Y.; Lesyk, R. B. Farm. Zh. (Kiev, Ukr.) 1994, 2, 52.
15. Clark, D. A.; Goldstein, S. W.; Hulin, B. U.S. Patent 5,036,079; Chem. Abstr. 1992, 116, 83663.
16. Fabretti, A. C.; Franchini, G.; Peyronel, G.; Ferrari, M. Polyhedron 1982, 1, 633.
17. Andreocci, M. V.; Cauletti, C.; Sestili, L. Spectrochim. Acta 1984, 40A, 1087.
18. Sanche, L.; Schulz, G. J. Phys. Rev. A 1972, 5, 1672.
19. Schulz, G. J. Rev. Mod. Phys. 1973, 45, 378, 423.
20. Illenberger, E.; Momigny, J. Gaseous Molecular Ions. An Introduction to Elementary Processes Induced by Ionization; Steinkopff Verlag: Darmstadt, Germany, 1992.
21. Modelli, A.; Jones, D.; Rossini, S.; Distefano, G. Tetrahedron 1984, 40, 3257.
22. Modelli, A. Trends Chem. Phys. 1997, 6, 57.
23. Modelli, A.; Jones, D.; Distefano, G.; Tronc, M. Chem. Phys. Lett. 1991, 181, 361.
24. Modelli, A.; Venuti, M.; Szepes, L. J. Am. Chem. Soc. 2002, 124, 8498.
25. Modelli, A.; Jones, D.; Distefano, G. Chem. Phys. Lett. 1982, 86, 434.
26. Johnston, A. R.; Burrow, P. D. J. Electron Spectrosc. Relat. Phenom. 1982, 25, 119.
27. Modelli, A.; Foffani, A.; Scagnolari, F.; Jones, D. Chem. Phys. Lett. 1989, 163, 269.
28. Frisch, M. J.; Trucks, G. W.; Schlegel, H. B.; Scuseria, G. E.; Robb, M. A.; Cheeseman, J. R.; Montgomery, J. A.; VReven, T.; Kudin, K. N.; Burant, J. C.; Millam, J. M.; Iyengar, S. S.; Tomasi, J.; Barone, V.; Mennucci, B.; Cossi, M.; Scalmani, G.; Rega, N.; Petersson, G. A.; Nakatsuji, H.; Hada, M.; Ehara, M.; Toyota, K.; Fukuda, R.; Hasegawa, J.; Ishida, M.; Nakajima, T.; Honda, Y.; Kitao, O.; Nakai, H.; Klene, M.; Li, X.; Knox, J. E.; Hratchian, H. P.; Cross, J. B.; Bakken, V.; Adamo, C.; Jaramillo, J.; Gomperts, R.; Stratmann, R. E.; Yazyev, O.; Austin, A. J.; Cammi, R.; Pomelli, C.; Ochterski, J. W.; Ayala, P. Y.; Morokuma, K.; Voth, G. A.; Salvador, P.; Dannenberg, J. J.; Zakrzewski, V. G.; Dapprich, S.; Daniels, A. D.; Strain, M. C.; Farkas, O.; Malick, D. K.; Rabuck, A. D.; Raghavachari, K.; Foresman, J. B.; Ortiz, J. V.; Cui, Q.; Baboul, A. G.; Clifford, S.; Cioslowski, J.; Stefanov, B. B.; Liu, G.; Liashenko, A.; Piskorz, P.; Komaroni, I.; Martin, R. L.; Fox, D. J.; Keith, T.; Al-Laham, M. A.; Peng, C. Y.; Nanayakkara, A.; Challacombe, M.; Gill, P. M. W.; Johnson, B.; Chen, W.; Wong, M. W.; Gonzalez, C.; Pople, J. A. Gaussian 03, Revision D.01; Gaussian Inc.: Wallingford, CT, 2004.
29. Becke, A. D. J. Chem. Phys. 1993, 98, 5648.
30. Staley, S. S.; Strnad, J. T. J. Phys. Chem. 1994, 98, 161.
31. Guerra, M. Chem. Phys. Lett. 1990, 167, 315.
32. Chen, D. A.; Gallup, G. A. J. Chem. Phys. 1990, 93, 8893.
33. Simons, J.; Jordan, K. D. Chem. Rev. 1987, 87, 535.
34. Lane, N. F. Rev. Mod. Phys. 1980, 52, 29.
35. Modelli, A. Phys. Chem. Chem. Phys. 2003, 5, 2923.
36. Modelli, A.; Szepes, L. Chem. Phys. 2003, 286, 165.
37. Pshenichnyuk, S. A.; Asfandiarov, N. L.; Burrow, P. D. Russ. Chem. Bull., Int. Edit. 2007, 56, 1268.
38. Subasi, E.; Ercag, A.; Sert, S.; Senturk, O. S. Synth. React. Inorg., Met.-Org., Nano-Met. Chem. 2006, 36, 705.
39. Hehre, W. J.; Radom, L.; Schleyer, P. v. R.; Pople, J. A. Ab initio Molecular Orbital Theory; Wiley: New York, 1986.
40. Dunning, T. H., Jr.; Peterson, K. A.; Woon, D. E. Basis Sets: Correlation Consistent Sets in the Encyclopedia of Computational Chemistry; Schleyer, P. v. R., Ed.; John Wiley: Chichester, U.K., 1998.
41. Modelli, A.; Hajgató, B.; Nixon, F. J.; Nyulászi, L. J. Phys. Chem. A 2004, 108, 7440.
42. Modelli, A.; Mussoni, L.; Fabbri, D. J. Phys. Chem. A 2006, 110, 6482.
43. Modelli, A. J. Phys. Chem. A 2005, 109, 6193.
44. O'Malley, T. F. Phys. Rev. 1966, 150, 14.
45. Allan, M. Chem. Phys. 1983, 81, 235.
46. Vasil'ev, Y. V.; Mazunov, V. A.; Nazirov, E. R. Org. Mass Spectrom. 1991, 26, 739.
47. Modelli, A.; Burrow, P. D. Phys. Chem. Chem. Phys. 2009, 11, 8448.
48. Asfandiarov, N. L.; Fokin, A. I.; Lukin, V. G.; Nafikova, E. P.; Lomakin, G. S.; Fal'ko, V. S.; Chizhov, Yu. V. Rapid Commun. Mass Spectrom. 1999, 13, 1116.
49. Khvostenko, O. G.; Tuimedov, G. M. Rapid Commun. Mass Spectrom. 2006, 20, 3699.
50. Kopyra, J.; König-Lehmann, C.; Szamrej, I.; Illenberger, E. Int. J. Mass Spectrom. 2009, 285, 131.
51. Asfandiarov, N. L.; Pshenichnyuk, S. A.; Fokin, A. I.; Lukin, V. G.; Fal'ko, V. S. Rapid Commun. Mass Spectrom. 2002, 16, 1760.
52. Ibanescu, B. C.; May, O.; Monney, A.; Allan, M. Phys. Chem. Chem. Phys. 2007, 9, 3163.