Pd nanoclusters at the MgO(1 0 0) surface

Surface Science

Volumn 575, Issue 1-2, 2005, Pages 197-209

  Giordano, Livia ^a   Pacchioni, Gianfranco ^a  

^a UNIVERSITY OF MILANO BICOCCA   (Italy)

Author keywords

DFT calculations; Metal clusters; MgO surface; Nucleation and growth; Point defects

Indexed keywords

BINDING ENERGY; CRYSTAL GROWTH; CRYSTAL ORIENTATION; DIMERS; NANOSTRUCTURED MATERIALS; NUCLEATION; PALLADIUM; POINT DEFECTS; PROBABILITY DENSITY FUNCTION; SURFACE REACTIONS;

DENSITY FUNCTIONAL THEORY (DFT) CALCULATIONS; METAL CLUSTERS; MGO SURFACE; OXYGEN VACANCY;

MAGNESIA;

EID: 12244268658     PISSN: 00396028     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.susc.2004.11.024     Document Type: Article

References (35)

1. C.R. Henry Surf. Sci. Rep. 31 1998 231
2. M. Bäumer, and H.J. Freund Prog. Surf. Sci. 61 1999 127
3. L. Giordano, J. Goniakowski, and G. Pacchioni Phys. Rev. B 67 2003 045410
4. M. Moseler, H. Häkkinen, and U. Landman Phys. Rev. Lett. 89 2002 176103
5. L.M. Molina, and B. Hammer Phys. Rev. Lett. 90 2003 206102
6. S. Abbet, U. Heiz, H. Häkkinen, and U. Landman Phys. Rev. Lett. 86 2001 5950
7. K. Judai, S. Abbet, A.S. Wörz, U. Heiz, and C.R. Henry J. Am. Chem. Soc. 126 2004 2732
8. T.H. Lee, and R.M. Dickson Proc. Nation. Acad. Sci. 100 2003 3043
9. I. Yudanov, G. Pacchioni, K. Neyman, and N. Rösch J. Phys. Chem. 101 1997 2786
10. S. Wendt, Y.D. Kim, and D.W. Goodman Prog. Surf. Sci. 74 2003 141
11. A. Bogicevic, and D.R. Jennison Surf. Sci. 437 1999 L741
12. A. Bogicevic, and D.R. Jennison Surf. Sci. 515 2002 L481
13. G. Pacchioni Chem. Phys. Chem. 4 2003 1041
14. G. Spoto, E.N. Gribov, G. Ricchiardi, A. Damin, D. Scarano, S. Bordiga, C. Lamberti, and A. Zecchina Prog. Surf. Sci. 76 2004 71
15. L. Giordano, C. Di Valentin, J. Goniakowski, and G. Pacchioni Phys. Rev. Lett. 92 2004 096105
16. D. Vanderbilt Phys. Rev. B 41 1990 7892
17. J.P. Perdew, and Y. Wang Phys. Rev. B 45 1992 13244
18. G. Kresse, and J. Hafner Phys. Rev. B 47 1993 558
19. G. Kresse, and J. Furthmüller Phys. Rev. B 54 1996 11169
20. A.M. Ferrari, and G. Pacchioni J. Phys. Chem. 99 1995 17010
21. M. Ménétrey, A. Markovits, C. Minot, A. Del Vitto, and G. Pacchioni Surf. Sci. 549 2004 294
22. B. Hammer, personal communication
23. A.D. Becke Phys. Rev. A 38 1988 3098
24. J.P. Perdew Phys. Rev. B 33 1986 8822
25. J.P. Perdew Phys. Rev. B 34 1988 785
26. W. Stevens, H. Bach, and J. Krauss J. Chem. Phys. 81 1984 6026
27. P.V. Susko, A.L. Shluger, and C.R.A. Catlow Surf. Sci. 450 2000 153
28. M.J. Frisch et al., Gaussian 98, Revision A.6, Gaussian Inc., Pittsburgh, PA, 1998
29. P.J. Hay, and W.R. Wadt J. Chem. Phys. 82 1985 299
30. A.M. Ferrari, C. Xiao, K.M. Neyman, G. Pacchioni, and N. Rösch Phys. Chem. Chem. Phys. 1 1999 4655
31. V. Musolino, A. Selloni, and R. Car J. Chem. Phys. 108 1998 5044
32. G. Haas, A. Menck, H. Brune, J.V. Barth, J.A. Venables, and K. Kern Phys. Rev. B 61 2000 11105
33. L. Ojamäe, and C. Pisani J. Chem. Phys. 109 1998 10984
34. D. Ricci, G. Pacchioni, P.V. Sushko, and A.L. Shluger J. Chem. Phys. 117 2002 2844
35. L. Giordano, G. Pacchioni, A.M. Ferrari, F. Illas, and N. Rösch Surf. Sci. 473 2001 213