The importance of Pb-vacancy attractions on diffusion in the Pb/Cu(0 0 1) surface alloy

Surface Science

Volumn 538, Issue 1-2, 2003, Pages 53-58

  Anderson, M L ^a   Bartelt, N C ^b   Swartzentruber, B S ^a  

^a SANDIA NATIONAL LABORATORIES   (United States)

^b SANDIA NATIONAL LABORATORIES   (United States)

Author keywords

Copper; Density functional calculations; Lead; Palladium; Scanning tunneling microscopy; Surface diffusion

Indexed keywords

COMPUTER SIMULATION; CRYSTAL ORIENTATION; DIFFUSION IN SOLIDS; ELECTRONIC STRUCTURE; MOLECULAR DYNAMICS; PROBABILITY DENSITY FUNCTION; SCANNING TUNNELING MICROSCOPY; SURFACES;

DENSITY FUNCTIONAL THEORY (DFT); SURFACE ALLOYS;

COPPER ALLOYS;

EID: 0038749308     PISSN: 00396028     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0039-6028(03)00644-7     Document Type: Article

References (17)

1. Grant M.L., Swartzentruber B.S., Bartelt N.C., Hannon J.B. Phys. Rev. Lett. 86:2001;4588.
2. van Gastel R., Somfai E., van Albada S.B., van Saarloos W., Frenken J.W.M. Phys. Rev. Lett. 86:2001;1562.
3. Manning J.R. Diffusion Kinetics for Atoms in Crystals. 1968;Van Nostrand, Princeton.
4. Seitz F. Phys. Rev. 74:1948;1513.
5. Haasen P. Physical Metallurgy. third ed. 1996;Cambridge University Press, Cambridge. p. 128.
6. Nagl C., Platzgummer E., Haller O., Schmid M., Varga P. Surf. Sci. 331-333:1995;831.
7. Swartzentruber B.S. Phys. Rev. Lett. 76:1996;459.
8. Brummelhuis M.J.A.M., Hilhorst H.J. J. Stat. Phys. 53:1988;249.
9. Kresse G., Hafner J. Phys. Rev. B. 47:1993;558. 49 (1994) 14251 Kresse G., Furthmuller J. Comput. Mater. Sci. 6:1996;15 Phys. Rev. B. 54:1996;11169.
10. Kresse G., Hafner J. Phys. Rev. B. 47:1993;558. 49 (1994) 14251 Kresse G., Furthmuller J. Comput. Mater. Sci. 6:1996;15 Phys. Rev. B. 54:1996;11169.
11. Kresse G., Hafner J. Phys. Rev. B. 47:1993;558. 49 (1994) 14251 Kresse G., Furthmuller J. Comput. Mater. Sci. 6:1996;15 Phys. Rev. B. 54:1996;11169.
12. Vanderbilt D. Phys. Rev. B. 41:1990;7892 Pasquarello A., Laasonen K., Car R., Lee C., Vanderbilt D. Phys. Rev. B. 47:1993;10142 Kresse G., Hafner J. J. Phys.: Condens. Matter. 6:1994;8245.
13. Vanderbilt D. Phys. Rev. B. 41:1990;7892 Pasquarello A., Laasonen K., Car R., Lee C., Vanderbilt D. Phys. Rev. B. 47:1993;10142 Kresse G., Hafner J. J. Phys.: Condens. Matter. 6:1994;8245.
14. Vanderbilt D. Phys. Rev. B. 41:1990;7892 Pasquarello A., Laasonen K., Car R., Lee C., Vanderbilt D. Phys. Rev. B. 47:1993;10142 Kresse G., Hafner J. J. Phys.: Condens. Matter. 6:1994;8245.
15. Perdew J.P. Ziesche P., Eschrig H. Electronic Structure of Solids'91. 1991;Akademie Verlag, Berlin, J.P. Perdew, Y. Wang, unpublished.
16. Perdew J.P. Ziesche P., Eschrig H. Electronic Structure of Solids'91. 1991;Akademie Verlag, Berlin, J.P. Perdew, Y. Wang, unpublished.
17. Jonsson H., Mills G., Jacobsen K.W. Berne B.J., Ciccotti G., Coker D.F. Classical and Quantum Dynamics in Condensed Phase Simulations. 1998;World Scientific, Singapore.