A comparative study of empirical potential energy functions: Applications to clusters

International Journal of Modern Physics C

Volumn 11, Issue 3, 2000, Pages 451-467

  Gunes P ^a   Simsek S ^a   Erkoc S ^b  

^a GAZI UNIVERSITY   (Turkey)

^b MIDDLE EAST TECHNICAL UNIVERSITY   (Turkey)

Author keywords

Clusters; Empirical Potential Energy Functions

Indexed keywords

EID: 0042965849     PISSN: 01291831     EISSN: None     Source Type: Journal    
DOI: 10.1142/S0129183100000390     Document Type: Article

References (42)

1. G. Ciccotti, D. Frenkel, and I. R. McDonalt (eds.), Simulation of Liquids and Solids: Molecular Dynamics and Monte-Carlo Methods in Statistical Mechanics (North-Holland, 1989).
2. R. M. Nieminen, M. J. Pusha, and M. J. Manninen (eds.), Many-Atom Introductions in Solids (Springer-Verlag, 1990).
3. O. Sinanoglu, Adv. Chem. Phys. 12, 283 (1967).
4. Ş. Erkoç, Phys. Stat. Sol. (b) 152, 447 (1989); 155, 461 (1989).
5. Ş. Erkoç, Phys. Stat. Sol. (b) 152, 447 (1989); 155, 461 (1989).
6. Ş. Erkoç, Phys. Rep. 278, 79 (1997).
7. Ş. Erkoç, Phys. Stat. Sol. (b) 161, 211 (1990).
8. Ş. Erkoç, Phys. Stat. Sol. (b) 171, 317 (1992).
9. Ş. Erkoç, Z. Phys. D: Atoms, Molecules and Clusters 32, 257 (1994).
10. Ş. Erkoç, Tr. J. of Phys. 18, 507 (1994).
11. Ş. Erkoç, Chem. Phys. Lett. 173, 57 (1990).
12. J. Y. Fang, R. L. Johnston, and J. N. Murrell, J. Chem. Soc. Faraday Trans. 89, 1659 (1993).
13. K. A. Jackson, Phys. Rev. B 47, 9715 (1993).
14. B. Delley, D. E. Ellis, A. J. Freeman, E. J. Baerends, and D. Post, Phys. Rev. B 27, 2132 (1983).
15. E. A. Rohlfing and J. J. Valentini, Chem. Phys. Lett. 126, 113 (1986).
16. O. B. Christensen and K. W. Jacobsen, J. Phys.: Condens. Matter 5, 5591 (1993).
17. C. Massobrio, A. Pasquarello, and R. Car, Chem. Phys. Lett. 238, 215 (1995).
18. U. Lammers and G. Borstel, Phys. Rev. B 49, 17360 (1994).
19. K. Balasubramanian and P. Y. Feng, J. Phys. Chem. 94, 1536 (1990).
20. J. A. Howard and R. Sutcliffe, Surf. Sci. 156, 214 (1985).
21. H. Akeby, I. Panas, L. G. M. Pettersson, P. Siegbahn, and U. Wahlgren, J. Phys. Chem. 94, 5471 (1990).
22. Z. E. Bayyari, Phys. Stat. Sol. (b) 208, 339 (1998).
23. R. C. Baetzold, J. Chem. Phys. 55, 4363 (1971).
24. J. A. Howard, R. Sutcliffe, and B. Mile, J. Phys. Chem. 87, 2268 (1983).
25. V. B. Koutecky, L. Cespiva, P. Fantucci, J. Pittner, and J. Koutecky, J. Chem. Phys. 100, 490 (1994).
26. R. Santamania, I. G. Kaplan, and O. Novaro, Chem. Phys. Lett. 218, 395 (1994).
27. D. W. Liao and K. Balasubramanian, J. Chem. Phys. 97, 2548 (1992).
28. V. B. Koutecky, L. Cespiva, P. Fantucci, and J. Koutecky, J. Chem. Phys. 98, 7981 (1993).
29. A. Wucher and B. J. Garrison, Phys. Rev. B 46, 4855 (1992).
30. R. Poteau, J. L. Heully, and F. Spiegelmann, Z. Phys. D 40, 479 (1997).
31. J. Flad, G. Igel-mann, H. Preuss, and H. Stoll, Chem. Phys. 90, 257 (1984).
32. Ş. Erkoç and Ş. Katircioglu, Chem. Phys. Lett. 147, Chem. Phys. 91, 612 (1989).
33. Ş. Erkoç and Ş. Katircioglu, Chem. Phys. Lett. 147, Chem. Phys. 91, 612 (1989).
34. K. Balasubramanian, P. Y. Feng, and M. Z. Liao, J. Chem. Phys. 91, 3561 (1989).
35. C. W. Bauschlicher, S. R. Langhoff, and H. Partridge, J. Chem. Phys. 91, 2412 (1989).
36. J. Xie, J. A. Northby, D. L. Freeman, and J. D. Doll, J. Chem. Phys. 91, 612 (1989).
37. C. Ozdog and Ş. Erkoç, Z. Phys. D 41, 205 (1997).
38. O. D. Haberlen, S. Chung, M. Stener, and N. Rsch, J. Chem. Phys. 106, 5189 (1997).
39. G. D'Agostino, A. Pinto, and S. Mobilio, Phys. Rev. B 48, 14447 (1993).
40. J. Jortner, Z. Phys. D 24, 247 (1992).
41. C. Kittel, Introduction to Solid State Physics, 7th edition (Wiley, New York, 1996).
42. K. P. Huber and G. Herzberg, Constants of Diatomic Molecules (Van Nostrand Co., New York, 1979).