d contribution to the relaxation of transition metal surfaces at the end of the series

Surface Science

Volumn 364, Issue 3, 1996, Pages 396-408

  Moraitis, G ^a   Mokrani, A ^b   Demangeat, C ^a   M'passi Mabiala, B ^c  

^a INSTITUT DE PHYSIQUE ET CHIMIE DES MATÉRIAUX DE STRASBOURG   (France)

^b LPST   (France)

^c LME   (Congo)

Author keywords

Metallic surfaces; Nickel; Palladium; Rhodium; Semi empirical models; Surface relaxation

Indexed keywords

BAND STRUCTURE; ELECTRONIC DENSITY OF STATES; ELECTRONIC STRUCTURE; FERMI LEVEL; MATHEMATICAL MODELS; NICKEL; PALLADIUM; RELAXATION PROCESSES; RHODIUM; TRANSITION METALS;

METALLIC SURFACES; SEMI EMPIRICAL MODELS; SURFACE RELAXATION;

SURFACE PHENOMENA;

EID: 0030241390     PISSN: 00396028     EISSN: None     Source Type: Journal    
DOI: 10.1016/0039-6028(96)00630-9     Document Type: Article

References (50)

1. R.P. Feynman, Phys. Rev. 56 (1939) 340.
2. W.E. Pickett, Comput. Phys. Rep. 9 (1989) 115.
3. N.D. Lang and A.R. Williams, Phys. Rev. Lett. B 34 (1975) 531.
4. J. Ihm, A. Zunger and M.L. Cohen, J. Phys. C 12 (1979) 4409.
5. K.M. Ho, C. Elsasser, C.T. Chan and M. Falhe, J. Phys. Condens. Matter 4 (1992) 5189.
6. J.M. Soler and A.R. Williams, Phys. Rev. B 47 (1993) 6784.
7. R. Yu, D. Singh and H. Krakauer, Phys. Rev. B 43 (1991) 6411.
8. M. Fahnle, C. Elsasser and H. Krimmel, Phys. Status Solidi 191 (1995) 9.
9. M.R. McIntosh and O.K. Andersen, in: Electrons at the Fermi Surface, Ed. M. Springford (Cambridge University Press, Cambridge, 1980), p. 171.
10. M. Methfessel and M. van Schilfgaarde, Phys. Rev. B 48 (1993) 4937.
11. J. Harris, Phys. Rev. B 31 (1985) 1770.
12. W. Kohn and L.J. Sham, Phys. Rev. 140 (1965) A1133.
13. G. Moraitis, A. Mokrani, C. Demangeat, J. Goma-Maniongui and R. Elenga, Surf. Sci. 331-333 (1995) 1062.
14. B. Mpassi-Mabiala, G. Moraitis, A. Mokrani and C. Demangeat, Surf. Sci. (1996) in press.
15. F. Jona and P.M. Marcus, in: The structure of Surfaces II, Springer Series in Surface Sciences 11, Eds. J.F. Van der Veen and M.A. Van Hove (Springer, Berlin, 1988), p. 90.
16. M. Coppel and R. Gustafson, Bull. Am. Phys. Soc. 31 (1986) 323.
17. R. Gustafsson, M. Coppel and P. Fenter in: The Structure of Surfaces II, Springer Series in Surface Sciences 11, Eds. J.F. Van der Veen and M.A. Van Hove (Springer, Berlin, 1988), p. 110.
18. G. Allan and M. Lannoo, Surf. Sci. 40 (1973) 375.
19. G. Allan and M. Lannoo, Phys. Status Solidi B 74 (1976) 409.
20. G. Allan and M. Lannoo, Phys. Rev. B 37 (1988) 2678.
21. J.S. Luo and B. Legrand, Phys. Rev. B 38 (1988) 1728.
22. M. Methfessel, D. Hennig and M. Scheffler, Phys. Rev. B 46 (1992) 4816.
23. J. Quinn, Y.S. Li, D. Tian, H. Li, F. Jona and P.M. Marcus, Phys. Rev. B 42 (1990) 11348.
24. W. Oed, B. Dotsch, L. Hammer, K. Heinz and K. Muller, Surf. Sci. 207 (1988) 55.
25. W. Oed, H. Lindner, U. Starke, K. Heinz, K. Muller and J.B. Pendry, Surf. Sci. 224 (1989) 179.
26. J.E. Demuth, P.M. Marcus and D.W. Jepsen, Phys. Rev. B 11 (1975) 1460.
27. Y. Gauthier, R. Baudoing, D. Aberdam and C. Gaubert, in: Determination of Surface Structure by LEED, Eds. P.M. Marcus and F. Jona (Plenum, New York, 1989).
28. W.M. Frenken, R.G. Smeenkand and J.F. van der Veen, Surf. Sci. 135 (1983) 147; J.W.M. Frenken, J.F. van der Veen and G. Allan, Phys. Rev. Lett. 51 (1983) 1876.
29. W.M. Frenken, R.G. Smeenkand and J.F. van der Veen, Surf. Sci. 135 (1983) 147; J.W.M. Frenken, J.F. van der Veen and G. Allan, Phys. Rev. Lett. 51 (1983) 1876.
30. H.C. Lu, E.P. Gusev, E. Garfunkel and T. Gustafson, Surf. Sci. 352-354 (1996) 21.
31. P.J. Feibelman and D.R. Hamann, Surf. Sci. 234 (1990) 377.
32. A. Eichler, J. Hafner, G. Kresse, and J. Furthmuller Surf. Sci. 352-354 (1996) 689.
33. S.C. Wu, K. Garisson, A.M. Begley, F. Jona and P.D. Johnson, Phys. Rev. B 49 (1994) 14081.
34. B. Piveteau, D. Spanjaard and M.C. Desjonquéres, Phys. Rev. B 49 (1994) 8402.
35. C.T. Chan, K.P. Bohnen and K.M. Ho, Phys. Rev. B 47 (1993) 4771.
36. J. Friedel, The Physics of Metals, Ed. J.M. Ziman (Cambridge University Press, Cambridge, 1969) p. 340.
37. G. Moraitis, C. Demangeat and H. Dreyssé, J. Phys. Condens. Matter 2 (1990) 513.
38. P.J. Feibelman, Phys. Rev. B 45 (1992) 3842.
39. P. Pulay, Mol. Phys. 17 (1969) 197.
40. A. Vega, C. Demangeat, H. Dreysse and A. Chouairi, Phys. Rev. B 51 (1995) 11546, and references therein.
41. R. Haydock, Solid State Physics, Vol. 35 (Academic Press, New York, 1980).
42. M. Lannoo and G. Allan, Phys. Status Solidi B 31 (1977) 681.
43. C.M. Varma and A.J. Wilson, Phys. Rev. B 22 (1980) 3795.
44. W.A. Harisson, Electronic Structure and the Properties of Solids: The Physics of Chemical Bond (Freeman, San Francisco, 1980).
45. M.J. Kelly, Solid State Physics, Vol. 35 (Academic Press, New York, 1980), p. 296.
46. K. Takegahara, Y. Aoki and A. Yanase, J. Phys. C. Solid State Phys. 13 (1980) 583.
47. M.W. Finnis and V. Heine, J. Phys. F 4 (1979) L37.
48. K.W. Jacobsen, Commun. Condens. Matter Phys. 14 (1988) 129.
49. G. Moraitis and F. Gautier, J. Phys. F Metal Phys. 9 (1979) 2025.
50. A. Messiah, Quantum Mechanics (North-Holland, Amsterdam, 1969).