Chalcanthrene-fullerene complexes: A theoretical study

Journal of Organometallic Chemistry

Volumn 693, Issue 2, 2008, Pages 216-220

  Jalbout, A F ^a   Hameed, Ali Jameel ^b   Jimenez Fabian, I ^a   Ibrahim, Medhat ^c   de Leon, A ^a  

^a UNIVERSIDAD NACIONAL AUTÓNOMA DE MÉXICO   (Mexico)

^b UNIVERSITY OF BASRAH   (Iraq)

^c NATIONAL RESEARCH CENTRE   (Egypt)

Author keywords

BLYP; Chalcanthrenes; Frequencies; Fullerenes; Interaction energies; Structures

Indexed keywords

COMPLEXATION; DENSITY FUNCTIONAL THEORY; DISSOCIATION; ELECTRONIC PROPERTIES; FULLERENES;

BLYP; CHALCANTHRENES; INTERACTION ENERGIES;

ANTHRACENE;

EID: 37549049376     PISSN: 0022328X     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.jorganchem.2007.09.036     Document Type: Article

References (25)

1. In: Andrews D.I. (Ed). Energy Harvesting Materials (2005), World Scientific Publishing Co., Singapore
2. Kacholdt H., Berges P., Klar G., and Hinrichs W. Transition Met. Chem. 12 (1987) 515
3. Amato M.E., Grassi A., Irgolic K.J., Pappalardo G.C., and Radicss L. Organometallics 12 (1993) 775
4. Bracher P.J., and Schuster D.I. In: Guldi D.M., and Martín N. (Eds). Fullerenes: From Synthesis to Optoelectronic Properties (2002), Kluwer Academic Publishers, Dordrecht 163-212
5. Martin N., Sanchez L., Liescas B., and Perez I. Chem. Rev. 98 (1998) 2527
6. Imahori H., Tamaki K., Guldi D.M., Luo C.P., Fujitsuka M., Ito O., Sakata Y., and Fukuzumi S. J. Am. Chem. Soc. 123 (2001) 2607
7. Mizuseki H., Igarashi N., Belosludov R.V., Farajian A.A., and Kawazoe Y. Synthetic Metals 138 (2003) 281
8. Modin J., Johansson H., and Grennberg H. Org. Lett. 7 (2005) 3977
9. Hameed A.J. J. Mol. Struct. (THEOCHEM) 764 (2006) 195
10. Xie Q.S., Perezcordero E., and Echegoyen L. J. Am. Chem. Soc. 114 (1992) 3978
11. Imahori H., and Sakata Y. Eur. J. Org. Chem. 44 (1999) 2445
12. Gust D., Moore T.A., and Moore A.L. Acc. Chem. Res. 34 (2001) 40
13. Imahori H., and Sakata Y. Adv. Mater. 9 (1997) 537
14. Holzwarth A.R., Katterle M., Müller M.G., Ma Y.Z., and Prokhorenko V. Pure Appl. Chem. 73 (2001) 469
15. Fukuzumi S., Ohkubo K., Imahori H., Shao J.G., Ou Z.P., Zheng G., Chen Y.H., Pandey R.K., Fujitsuka M., Ito O., and Kadish K.M. J. Am. Chem. Soc. 123 (2001) 10676
16. Imahori H., Guldi D.M., Tamaki K., Yoshida Y., Luo C.P., Sakata Y., and Fukuzumi S. J. Am. Chem. Soc. 123 (2001) 6617
17. Mizuseki H., Igarashi N., Belosludov R.V., Farajian A.A., and Kawazoe Y. Jpn. J. Appl. Phys. 42 (2003) 2503
18. Delley B. J. Chem. Phys. 92 (1990) 508
19. Kamiya M., Tsuneda T., and Hirao K. J. Chem. Phys. 117 (2002) 6010
20. Basiuk V.A. J. Phys. Chem. A 109 (2005) 3704
21. Konarev D.V., Yudanova E.I., Neretin I.S., Slovokhotov L.Y., and Lyubovskaya R.N. Synth. Met. 121 (2001) 1125
22. Jalbout A.F., Trzaskowski B., and Hameed A.J. J. Organomet. Chem. 691 (2006) 4589
23. Jalbout A.F., Hameed A.J., and Trzaskowski B. J. Organomet. Chem. 692 (2007) 1039
24. A.F. Jalbout, F.F. Contreras-Torres, A.J. Hameed, B. Trzaskowski, V.A. Basiuk, J. Comput. Theor. Nanosci., in press.
25. Hameed A.J., Jalbout A.F., and Trzaskowski B. Int. J. Quantum Chem. 107 (2007) 152