Comparative theoretical study of the Ag-MgO (100) and (110) interfaces

Surface Science

Volumn 441, Issue 2-3, 1999, Pages 373-383

  Zhukovskii, Yu F ^a,b   Kotomin, E A ^a,c   Jacobs, P W M ^b   Stoneham, A M ^d   Harding, J H ^d  

^a UNIVERSITY OF LATVIA   (Latvia)

^b UNIVERSITY OF WESTERN ONTARIO   (Canada)

^c UNIVERSITY OF OSNABRÜCK   (Germany)

^d UNIVERSITY COLLEGE LONDON   (United Kingdom)

Author keywords

[No Author keywords available]

Indexed keywords

ADHESION; ADSORPTION; BINDING ENERGY; CARRIER CONCENTRATION; CHEMICAL BONDS; CRYSTAL ATOMIC STRUCTURE; ELECTRONIC STRUCTURE; ELECTROSTATICS; MAGNESIA; MATHEMATICAL MODELS; SILVER; SURFACE STRUCTURE;

HARTREE-FOCK METHOD; IMAGE INTERACTION MODEL;

INTERFACES (MATERIALS);

EID: 0033226017     PISSN: 00396028     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0039-6028(99)00847-X     Document Type: Article

References (62)

1. Heinrich V.E., Cox P.A. The Surface Science of Metal Oxides. 1994;Cambridge University Press, Cambridge.
2. Ernst F. Mater. Sci. Eng. R14:1995;97.
3. Finnis M.W. J. Phys.: Condensed Matter. 8:1996;5811.
4. Campbell C.T. Surf. Sci. Rep. 27:1997;1.
5. Renaud G. Surf. Sci. Rep. 32:1998;1.
6. Freund H.-J., Bäumer M., Libuda J., Kuhlenbeck H., Risse T., Al-Shamery K., Hamann H. Crystallogr. Res. Tech. 33:1998;977.
7. Stoneham A.M., Tasker P.W. Pask J.A., Evans A.G. Ceramic Microstructures '86. 1987;155 Plenum.
8. Ertl G., Freund H.-J. Phys. Today. (1):1999;32.
9. Proceedings of 4th International Symposium on Atomically Controlled Surfaces and Interfaces. Appl. Surf. Sci. 130-132:1998.
10. Stoneham A.M., Harding J., Harker T. Mater. Res. Soc. Bull. 21:1996;29.
11. Stoneham A.M. Appl. Surf. Sci. 14:1983;249.
12. Stoneham A.M., Tasker P.W. J. Phys. C. 18:1985;L543. also Harwell, reprint TP1122.
13. Tasker P.W., Stoneham A.M. J. Phys. (Paris). 84:1987;149.
14. Stoneham A.M., Tasker P.W. Pask J.A., Evans A.G. Ceramic Microstructures '87: Role of Interfaces. 1986;155 Plenum, Press.
15. Tasker P.W., Stoneham A.M. Mater. Sci. Eng. 4:1988;382.
16. Finnis M.W., Stoneham A.M., Tasker P.W. Rühle M. Metal-Ceramic Interfaces. 1990;35 Pergamon, Oxford.
17. Stoneham A.M., Tasker P.W. Peteves S.D. Designing Interfaces for Technological Applications. vol. 16:1989;217 Elsevier.
18. Stoneham A.M., Duffy D.M., Harding J.H., Tasker P.W. Peteves S.D. Designing Ceramic Interfaces. 1993;573 CEC Directorate General, Science Research and Development. also AEA-InTec-0708.
19. Duffy D.M., Harding J.H., Stoneham A.M. Acta Metall. Mater. 40:(Suppl.):1992;S11.
20. Duffy D.M., Harding J.H., Stoneham A.M. appendix by J.R. Willis Philos. Mag. A: 67:1993;865.
21. Duffy D.M., Harding J.H., Stoneham A.M. J. Appl. Phys. 76:1995;2791.
22. Stoneham A.M., Duffy D.M., Harding J.H. Eustathopoulos N. High Temperature Capillarity. 1994;1 Slovak Academy of Sciences.
23. Duffy D.M., Harding J.H., Stoneham A.M. Acta Metall. Mater. 43:1995;1559.
24. Harding J.H., Harker A.H., Shluger A.L., Stoneham A.M. Acta Metall. Mater. 46:1998;2255.
25. Duffy D.M., Harding J.H., Stoneham A.M. Acta Metall. Mater. 44:1996;3293.
26. Trampert A., Ernst E., Flynn C.P., Fischmeister H.F., Ruhle M. Acta Metall. Mater. 40:1992;S227.
27. Guenard P., Renaud G., Vilette B., Yang M.-H., Flynn C.P. Scr. Metall. Mater. 31:1994;1221.
28. Schaffner M.-H., Patthey F., Schneider W.-D. Surf. Sci. 417:1998;159.
29. Harada T., Asano M., Mizutani Y. J. Cryst. Growth. 116:1992;243.
30. Didier F., Jupille J. Surf. Sci. 307-309:1994;587.
31. Harding J.H., Stoneham A.M., Venables J.A. Phys. Rev. B. 57:1998;6715.
32. Bacalis N.C., Kunz A.B. Phys. Rev. B. 32:1985;4857.
33. Ferrari A.M., Pacchioni G. J. Phys. Chem. 99:1995;17 010.
34. Ferrari A.M., Pacchioni G. J. Phys. Chem. 100:1996;9032.
35. Stoneham A.M., Harding J.H. Acta Metall. Mater. 46:1998;1155.
36. Schönberger U., Andersen O.K., Methfessel M. Acta Metall. Mater. 40:1992;S1.
37. Goniakowski J. Phys. Rev. B. 57:1998;1935.
38. Goniakowski J. Phys. Rev. B. 58:1998;1189.
39. Li C., Wu R., Freeman A.J., Fu C.L. Phys. Rev. B. 48:1993;8317.
40. Hong T., Smith J.R., Srolovitz D.J. J. Adhesion Sci. Technol. 8:1994;837.
41. Hong T., Smith J.R., Srolovitz D.J. Acta Metall. Mater. 43:1995;2721.
42. Pacchioni G., Rösch N. J. Chem. Phys. 104:1996;7329.
43. Yudanov I.V., Vent S., Neyman K., Pacchioni G., Rösch N. Chem. Phys. Lett. 275:1997;245.
44. Heifets E., Kotomin E.A., Orlando R. J. Phys.: Condensed Matter. 8:1996;6577.
45. Heifets E., Zhukovskii Yu.F., Kotomin E.A., Causa M. Chem. Phys. Lett. 283:1998;395.
46. Purton J., Parker S.C., Bullett D.W. J. Phys.: Condensed Matter. 9:1997;5709.
47. Dovesi R., Saunders V.R., Roetti C., Causá M., Harrison N.M., Orlando R., Aprá E. CRYSTAL-95 User Manual. 1996;University of Turin.
48. Causá M., Zupan A. Chem. Phys. Lett. 220:1994;145.
49. Perdew J.P., Wang Y. Phys. Rev. B. 45:1991;13 244.
50. Causá M., Dovesi R., Pisani C., Roetti C. Surf. Sci. 175:1986;551.
51. Hay P.J., Wadt W.R. J. Chem. Phys. 82:1985;284.
52. Aprá E., Stefanovich E.V., Dovesi R., Roetti C. Chem. Phys. Lett. 186:1991;329.
53. Wyckoff R.W.G. 2nd edition Crystal Structures. vol. 1:1963;Wiley-Interscience, New York.
54. Causá M., Kotomin E.A., Pisani C., Roetti C. J. Phys. C. 20:1977;4391.
55. Guenard P., Renaud G., Villette B. Physica B. 221:1996;205.
56. Kaden C., Ruggerone P., Toennies J.P., Zhang G., Benedek G. Phys. Rev. B. 46:1992;13 509.
57. Grimes R.W., Catlow C.R.A., Stoneham A.M. J. Phys.: Condensed Matter. 1:1989;7367.
58. He J.-W., Møller P.J. Chem. Phys. Lett. 129:1986;13.
59. He J.-W., Møller P.J. Surf. Sci. 178:1986;934.
60. He J.-W., Møller P.J. Surf. Sci. 180:1987;934.
61. Astrup I., Møller P.J. Appl. Surf. Sci. 33-34:1988;143.
62. Meunier M., Henry C.R. Surf. Sci. 307:1994;514.