A theoretical investigation on fullerene-like phosphorus clusters

Chemical Physics Letters

Volumn 396, Issue 1-3, 2004, Pages 27-33

  Han, Ju Guang ^a   Morales, Jorge A ^a  

^a TEXAS TECH UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

FULLERENE; PHOSPHORUS;

ANALYTIC METHOD; ARTICLE; CALCULATION; CLUSTER ANALYSIS; DENSITY FUNCTIONAL THEORY; DISSOCIATION; ENERGY; MOLECULE; NANOTECHNOLOGY; QUANTUM THEORY;

EID: 7944228562     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cplett.2004.07.107     Document Type: Article

References (35)

1. P.W. Fowler, and D.E. Manolopoulos An Atlas of Fullerenes 1995 Clarendon Press Oxford
2. J.G. Han, Z.Y. Ren, L.S. Sheng, Y.W. Zhang, J.A. Morales, and F. Hagelberg J. Mol. Struct. (Theochem) 625 2003 47 58
3. C.H. Hu, M.Z. Shen, and H.F. Schaefer III Theor. Chim. Acta 88 1994 29
4. H. Shinohara Rep. Prog. Phys. 63 2000 843
5. J. Lu, X.W. Zhang, and X.G. Zhao Chem. Phys. Lett. 332 2000 51
6. R.O. Jones, and D. Hohl J. Chem. Phys. 92 1990 6710
7. R.O. Jones, G. Gantefor, S. Hunsicker, and P. Pieperhoff J. Chem. Phys. 103 1995 9549
8. T.P. Martin Z. Phys. D 3 1986 211
9. R.B. Huang, H.D. Li, Z.Y. Lin, and S.H. Yang J. Phys. Chem. 99 1995 1418
10. A.V. Bulgakov, O.F. Bobrenok, and V.I. Kosyakov Chem. Phys. Lett. 320 2000 19
11. H.J. Zhai, L.S. Wang, A.E. Kuznetsov, and A.I. Boldyrev J. Phys Chem. A 106 2002 5600
12. A.V. Bulgakov, O.F. Bobrenok, V.I. Kosyakov, I. Ozerov, W. Marine, M. Heden, F. Rohmund, and E.E.B. Campbell Phys. Solid State 44 2002 617
13. O.J. Scherer Angew. Chem. Int. Edit 39 2000 1029
14. B. Song, and P.L. Cao Phys. Lett. A 291 2001 343
15. M.D. Chen, H.B. Lou, M.H. Liu, Q.E. Zhang, and C.T. Au Main Group Met. Chem. 23 2000 413
16. G. Seifert, T. Heine, and P.W. Fowler Eur. Phys. J. D 16 2001 341
17. M.D. Chen, J.T. Li, R.B. Huang, L.S. Zheng, and C.T. Au Chem. Phys. Lett. 305 1999 439
18. M. Haser, and O. Treutler J. Chem. Phys. 102 1995 3703
19. D. Hohl, and R.O. Jones Phys. Rev. B 45 1992 8995
20. M.D. Chen, R.B. Huang, L.S. Zheng, Q.E. Zhang, and C.T. Au Chem. Phys. Lett. 325 2000 22
21. M. Haser J. Am. Chem. Soc. 116 1994 6925
22. H. Thurn, and H. Krebs Acta Cryst. B 25 1969 125
23. M. Häser, U. Schneider, and R. Ahlrichs J. Am. Chem. Soc. 114 1992 9551
24. M. Häser, and O. Treutler J. Chem. Phys. 102 1995 3703
25. M. Häser J. Am. Chem. Soc. 116 1994 6925
26. R.G. Parr, and W. Yang Density-Functional Theory of Atoms and Molecules 1989 Oxford University Press
27. D. Porezag, T. Frauenheim, T. Kohler, G. Seifert, and R. Kaschner Phys. Rev. B 51 1995 12947
28. E. Albertazzi, C. Domene, P.W. Fowler, T. Heine, G. Seifert, C. Van Alsenoy, and F. Zerbetto Phys. Chem. Chem. Phys. 1 1999 2913
29. J.G. Han, J.A. Morales, in preparation (2004)
30. A.D. Becke J. Chem. Phys. 98 1993 1372
31. C. Lee, W. Yang, and R.G. Parr Phys. Rev. B. 37 1988 785
32. M.M. Francl, W.J. Pietro, W.J. Hehre, J.S. Binkley, M.S. Gordon, D.J. Defrees, and J.A. Pople J. Chem. Phys. 77 1982 3654
33. M.J. Frisch, G.W. Trucks, H.B. Schlegel, G.E. Scuseria, M.A. Robb, J.R. Cheeseman, V.G. Zakrzewski, J.A. Montgomery, 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. Pettersson, P.Y. Ayala, Q. Cui, K. Morokuma, D.K. Malick, A.D. Rabuck, K. Raghavachari, J.B. Foresman, J. Cioslowski, J.V. Ortiz, B.B. Stefanov, G. Liu, A. Liashenko, P. Piskorz, I. Komoromi, R. Gomperts, R.L. Martin, D.J. Fox, T. Keith, M.A. Al-Laham, C.Y. Peng, A. Nanayakkara, C. Gonzalez, M. Head-Gordon, E.S. Replogle, and J.A. Pople Gaussian 98 1998 Gaussian Inc Pittsburgh, PA
34. K.B. Huber, and G. Herzberg Molecular Spectra and Molecular Structure 1939 1979 Prentice-Hall New York
35. N.J. Brassington, H.G.M. Edwards, and D.A. Long J. Raman Spectrosc. 11 1981 346