Reactivity of a reduced metal oxide surface: Hydrogen, water and carbon monoxide adsorption on oxygen defective rutile TiO2(1 1 0)

Surface Science

Volumn 524, Issue 1-3, 2003, Pages 49-62

  Menetrey, M ^a   Markovits, A ^a   Minot, C ^a  

^a SORBONNE UNIVERSITÉ   (France)

Author keywords

Carbon monoxide; Chemisorption; Density functional calculations; Hydrogen atom; Hydrogen molecule; Oxygen; Physical adsorption; Titanium oxide; Water

Indexed keywords

ADSORPTION; CARBON MONOXIDE; CHEMISORPTION; HYDRATION; HYDROGEN; HYDROGENATION; POSITIVE IONS; PROBABILITY DENSITY FUNCTION; STOICHIOMETRY; TITANIUM DIOXIDE;

PHYSICAL ADSORPTION;

SURFACE PHENOMENA;

EID: 0035263155     PISSN: 00396028     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0039-6028(02)02464-0     Document Type: Article

References (63)

1. Fujishima A., Honda K. Nature. 238:1972;37.
2. Reinhardt P., Heß B.A. Phys. Rev. B. 50:1994;12015.
3. Ramamoorthy M., Vanderbilt D., King-Smith R.D. Phys. Rev. B. 49:1994;16721.
4. Linsebigler A., Lu G., Yates J.T. Jr. Chem. Rev. 95:1995;735.
5. Schwab G.M. Trans. Faraday Soc. 42:1946;689.
6. Raupp G.B., Dumesic J.A. J. Phys. Chem. 89:1985;5240.
7. Noguera C. Chimie et physique des surfaces d'oxydes. 1995;Eyrolles, Paris.
8. 2(1 1 0) surfaces Chaer Nascimento M.A. Progress in Theoretical Chemistry and Physics. 7:2001;241 Kluwer, Dordrecht.
9. Ahdjoudj J., Makovits A., Minot C. Catal. Today. 50:1999;541.
10. Fahmi A., Minot C. Surf. Sci. 304:1994;343.
11. Linsebigler A., Lu G., Yates J.T. Jr. Chem. Rev. 95:1995;735.
12. Heinrich V. Rep. Prog. Phys. 48:1985;1481.
13. Charlton G., Howes P.B., Nicklin C.L., Steadman P., Taylor J.S.G., Muryn C.A., Harte S.P., Mercer J., McGrath R., Norman D., Turner T.S., Thornton G. Phys. Rev. Lett. 78:1997;495.
14. Albaret T., Finocchi F., Noguera C. Faraday Discuss. 114:1999;285.
15. Ahdjoudj J., Fahmi A., Minot C. Surf. Sci. 352-354:1996;529.
16. Sorescu D.C., Yates J.T. Jr. J. Phys. Chem. 102:1998;4556.
17. Sorescu D.C., Rusu C.N., Yates J.T. Jr. J. Phys. Chem. 106:2002;6184.
18. Pacchioni G., Ferrari A.M., Bagus P.S. Surf. Sci. 350:1994;159.
19. Fahmi A., Minot C. J. Organomet. Chem. 478:1994;67.
20. Illas F., Pacchioni G., Pelmenschikov A., Petterson L.G.M., Dovesi R., Pisani C., Neyman K.M., Rösch N. Chem. Phys. Lett. 306:1999;202.
21. Sensato F.R., Custodio R., Calatayud M., Beltran A., Andres J., Sambrano J.R., Longo E. Surf. Sci. 511:2002;408.
22. Reuter K., Scheffler M. Phys. Rev. B. 65:2001;355406.
23. Tsukada M., Adachi H., Satoko C. Prog. Surf. Sci. 14:1983;113.
24. Ramamoorthy M., King-Smith R.D., Vanderbilt D. Phys. Rev. B. 49:1994;7709.
25. Munnix S., Schmeits M. Phys. Rev. B. 31:1985;3369.
26. Fischer S., Munz A.W., Schierbaum K.-D., Göpel W. Surf. Sci. 337:1995;17.
27. Heinrich V., Dresselhaus G., Zeiger H.J. Phys. Rev. Lett. 36:1976;1335.
28. Göpel W., Rocker G., Feierabend R. Phys. Rev. B. 28:1983;3427.
29. Schaub R., Thostrup P., Lopez N., Laegsgaard E., Stensgaard I., Norskov J.K., Besenbacher F. Phys. Rev. Lett. 87:2001;266104.
30. Paxton A.T., Thiên-Nga L. Phys. Rev. B. 57:1998;1579.
31. Leconte J., Markovits A., Skalli M.K., Minot C., Belmajdoub A. Surf. Sci. 497:2002;194.
32. Kresse G., Hafner J. Phys. Rev. B. 47:1993;558.
33. Kresse G., Hafner J. Phys. Rev. B. 48:1993;13115.
34. Kresse G., Hafner J. Phys. Rev. B. 49:1994;14251.
35. 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.
36. Perdew J.P., Wang Y. Phys. Rev. B. 45:1992;13244.
37. Vanderbilt D. Phys. Rev. B. 41:1990;7892.
38. Kresse G., Hafner J. J. Phys. Condens. Matter. 6:1994;8245.
39. Bredow T., Pacchioni G. Chem. Phys. Lett. 355:2002;417.
40. Harrison N.M., Wangi X.-G., Muscat J., Scheffler M. Faraday Discuss. 114:1999;305.
41. Langel W. Surf. Sci. 496:2002;141.
42. Handbook of Chemistry and Physics. 58th ed. 1977;CRC Press, Cleveland.
43. Heinrich V., Dresselhaus G., Zeiger H.J. Solid State Commun. 24:1977;623.
44. Pan J.-M., Maschoff B.L., Diebold U., Madey T.E. J. Vac. Sci. Technol. A. 10:1992;2470.
45. Bredow T., Jug K. Surf. Sci. 327:1995;398.
46. Goniakowski J., Bouette-Russo S., Noguera C. Surf. Sci. 284:1993;315.
47. Goniakowski J., Noguera C. Surf. Sci. 330:1995;337.
48. Goniakowski J., Gillan M.J. Surf. Sci. 350:1996;145.
49. Lindan P.J.D., Harrison N.M., Gillan M.J. Phys. Rev. Lett. 80:1998;762.
50. Lindan P.J.D., Harrison N.M., Holender J.M., Gillan M.J. Chem. Phys. Lett. 261:1996;246.
51. Ferris K.F., Wang L.-Q. J. Vac. Sci. Technol. A. 16:1998;956.
52. Stefanovich E.V., Truong T.N. Chem. Phys. Lett. 299:1999;623.
53. Casarin M., Maccato C., Vittadini A. J. Chem. Phys. B. 102:1998;10745.
54. Brinkley D., Dietrich M., Engel T., Farrall P., Gantner G., Schafer A., Szuchmacher A. Surf. Sci. 395:1998;292.
55. Muryn C.A., Hardman P.J., Crouch J.J., Raiker C.N., Thornton G. Surf. Sci. 251/252:1991;747.
56. Henderson M.A. Surf. Sci. 355:1996;151.
57. Henderson M.A. Langmuir. 12:1996;5093.
58. Henrich V.E. Prog. Surf. Sci. 9:1979;143.
59. Heinrich V., Kurtz R.L. J. Vac. Sci. Technol. 18:1981;416.
60. Heinrich V., Kurtz R.L. Phys. Rev. B. 22:1981;6280.
61. Vannice M.A., Sudhakar C. J. Phys. Chem. 88:1984;2429.
62. Kobayashi H., Yamagushi M. Surf. Sci. 214:1989;466.
63. Linsebigler A., Lu G., Yates J.T. Jr. J. Phys. Chem. 103:1995;9438.