Hydrogen, sulphur and chlorine coadsorption on Pd(111): a theoretical study of poisoning and promotion

Surface Science

Volumn 430, Issue 1, 1999, Pages 176-191

  Gravil, P A ^a   Toulhoat, H ^a  

^a IFP ENERGIES NOUVELLES   (France)

Author keywords

[No Author keywords available]

Indexed keywords

ATOMS; CATALYSIS; CHEMISORPTION; CHLORINE; DIFFUSION; GAS ADSORPTION; HYDROGEN; MOLECULAR STRUCTURE; PALLADIUM; PROBABILITY DENSITY FUNCTION; SULFUR; SURFACES;

ADATOMS; ADSORPTION ENERGY; COADSORPTION; DENSITY FUNCTIONAL CALCULATIONS; HYDROGEN ADSORPTION; LOW INDEX SINGLE CRYSTAL SURFACES; PROMOTION; SULPHUR POISONED SURFACE;

CATALYST POISONING;

EID: 0032631378     PISSN: 00396028     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0039-6028(99)00432-X     Document Type: Article

References (39)

1. Oudar J. Catal. Rev. Sci. Eng. 22:1980;171. and references cited therein.
2. Barbier J., Lamy-Pitara E., Marecot P., Boitiaux J.P., Cosyns J., Verna F. Adv. Catal. 37:1990;279. and references cited therein.
3. Oudar J., Pinol S., Pradier C.M., Berthier Y. J. Catal. 107:1987;445.
4. Oudar J., Pradier C.M., Vassilakis D., Berthier Y. Catal. Lett. 1:1987;339.
5. Pradier C.M., Berthier Y. Bull. Soc. Chim. Fr. 3:1985;317.
6. Outdar J. Catal. Rev. Sci. Eng. 22:1980;171.
7. Kiskinova M., Goodman D.W. Surf. Sci. 108:1981;64.
8. Taylor A.O., Hayward D.O. Surf. Sci. 346:1996;222.
9. Rendulic K.D., Anger G., Winkler A. Surf. Sci. 208:1989;404.
10. Burke M.L., Madix R.J. Surf. Sci. 237:1990;1.
11. Brand J.L., Deckert A.A., George S.M. Surf. Sci. 194:1988;457.
12. Guenin M., Breysse M., Frety R., Tifouti K., Marecot P., Barbier J. J. Catal. 105:1987;144.
13. M.-L. Hély, Ph.D. thesis, Université Pierre et Marie Curie (Paris VI), 1995.
14. Gravil P.A., Toulhoat H. Surf. Sci. 430:1999;192.
15. Kresse G., Hafner J. Phys. Rev. B. 49:1994;14 251.
16. Kresse G., Furthmuller J. Comput. Mater. Sci. 6:1995;15.
17. Kresse G., Furthmuller J. Phys. Rev. B. 54:1996;11 169.
18. Perdew J.P., Chevary J.A., Vosko S.H., Jackson K.A., Pederson M.R., Singh D.J., Fiolhais C. Phys. Rev. B. 46:1992;6671.
19. Vanderbilt D. Phys. Rev. B. 41:1990;7892.
20. Kresse G., Hafner J. J. Phys.: Condens. Matter. 6:1994;8245.
21. Monkhorst H.J., Pack J.D. Phys. Rev. B. 13:1976;5188.
22. Methfessel M., Paxton A.T. Phys. Rev. B. 40:1989;3616.
23. Yoon H.A., Salmeron M., Somorjai G.A. Surf. Sci. 395:1998;268. and references cited therein.
24. Forbes J.G., Gellman A.J., Dunphy J.C., Salmeron M. Surf. Sci. 279:1992;68.
25. Erley W. Surf. Sci. 94:1980;281.
26. Feibelman P.J. Phys. Rev. B. 56:1997;2175.
27. Feibelman P.J., Hamann D.R. Phys. Rev. Lett. 52:1984;61.
28. Feibelman P.J., Hamann D.R. Surf. Sci. 149:1985;281.
29. Smith N.V., Chen C.T. Surf. Sci. 247:1991;133.
30. Dunphy J.C., McIntyre B.J., Gomez J., Ogletree D.F., Somorjai G.A. J. Chem. Phys. 100:1994;6092.
31. McIntyre B.J., Salmeron M., Somorjai G.A. Surf. Sci. 300:1995;189.
32. Yang H., Whitten J.L. Surf. Sci. 370:1997;136.
33. Dong W., Kresse G., Hafner J. J. Mol. Catal. 119:1997;69.
34. Dong W., Hafner J. Phys. Rev. B. 1999;. in press.
35. G. Valerio, H. Toulhoat, unpublished results.
36. Hammer B., Norskov J.K. Nature. 376:1995;238.
37. Wilke S., Scheffler M. Phys. Rev. B. 53:1996;4926.
38. Wilke S., Scheffler M. Surf. Sci. 329:1995;L605.
39. Wilke S., Scheffler M. Phys. Rev. Lett. 76:1996;3380.