Role of kinetics in the selective surface oxidations of transition metal carbides

Journal of Physical Chemistry B

Volumn 110, Issue 31, 2006, Pages 15454-15458

  Zhang, Y F ^a,b   Vines F ^c   Xu, Y J ^d   Li, Y ^a,b   Li, J Q ^a,b   Illas, F ^c  

^a FUZHOU UNIVERSITY   (China)

^b FUJIAN INSTITUTE OF RESEARCH ON THE STRUCTURE OF MATTER   (China)

^c UNIVERSITY OF BARCELONA   (Spain)

^d CARDIFF UNIVERSITY   (United Kingdom)

Author keywords

[No Author keywords available]

Indexed keywords

DISSOCIATION; MOLECULAR DYNAMICS; OXIDATION; SURFACE CHEMISTRY; THERMODYNAMIC STABILITY; TRANSITION METALS;

KINETIC EFFECTS; METAL SURFACE SITES; SURFACE OXIDATIONS; TRANSITION METAL CARBIDES;

TITANIUM CARBIDE;

EID: 33748271967     PISSN: 15206106     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp0616056     Document Type: Article

References (32)

1. Toth, L. E. Transition Metal Carbides and Nitrides; Academic Press: New York, 1971.
2. Hwu, H. H.; Chen, J. G. Chem. Rev. 2005, 105, 185.
3. Johansson, L. I. Surf. Sci. Rep. 1995, 21, 177.
4. Vines, F.; Sousa, C.; Liu, P.; Rodriguez, J. A.; Illas, F. J. Chem. Phys. 2005, 122, 174709.
5. Chen, J. G. Chem. Rev. 1996, 96, 1477.
6. Bellucci, A.; Gozzi, D.; Kimura, T.; Noda, T.; Otani, S. J. Am. Ceram. Soc. 2003, 86, 2116.
7. Kuramochi, H.; Takami, K.; Saito, A.; Kuwahara, Y.; Mori, Y.; Otani, S.; Aono, M. Appl. Phys. Lett. 1999, 75, 3784.
8. Rodriguez, J. A.; Liu, P.; Dvorak, J.; Jirsak, T.; Gomes, J.; Takahashi, Y.; Nakamura, K. J. Chem. Phys. 2004, 121, 465.
9. Frantz, P.; Didziulis, S. V. Surf. Sci. 1998, 412/413, 384.
10. Didziulis, S. V.; Butcher, K. D.; Perry, S. S. Inorg. Chem. 2003, 42, 7766.
11. Souda, R.; Aizawa, T.; Otani, S.; Ishizawa, Y.; Oshima, C. Surf. Sci. 1991, 256, 19.
12. Merrill, P. B.; Perry, S. S. Surf. Sci. 1998, 418, 342.
13. Rodriguez, J. A.; Liu, P.; Gomes, J.; Nakamura, K.; Vines, F.; Sousa, C.; Illas, F. Phys. Rev. B 2005, 72, 075427.
14. Bellucci, A.; Gozzi, D.; Nardone, M.; Sodo, A. Chem. Mater. 2003, 15, 1217.
15. Kitaoka, H.; Ozawa, K.; Edamoto, K.; Otani, S. Surf. Sci. 2002, 511, 359.
16. Shirotori, Y.; Sawada, K.; Ozawa, K.; Edamoto, K.; Otani, S. Jpn. J. Appl. Phys. 1 2003, 42, 1725.
17. Zhang, Y. F.; Li, J. Q.; Liu, Z. F. J. Phys. Chem. B 2004, 108, 17143.
18. Janson, S. A.; Hoffmann, R. Surf. Sci. 1988, 197, 474.
19. Zhang, Y. F.; Ding, K. N.; Lin, W.; Li, J. Q. Acta Phys. Sin. 2005, 54, 1352.
20. Perdew, J.; Wang, Y. Phys. Rev. B 1992, 45, 13244.
21. Vanderbilt, D. Phys. Rev. B 1990, 41, 7892.
22. Kresse, G.; Furthmuller, J. Phys. Rev. B 1996, 54, 11169.
23. Kresse, G.; Furthmuller, J. Comput. Mater. Sci. 1996, 6, 15.
24. Kresse, G.; Hafner, J. Phys. Rev. B 1993, 47, 558.
25. Kresse, G.; Hafner, J. Phys. Rev. B 1994, 49, 14251.
26. Henkelman, G.; Jonsson, H. J. Chem. Phys. 2000, 113, 9978.
27. Henkelman, G.; Uberuaga, B. P.; Jonsson, H. J. Chem. Phys. 2000, 113, 9901.
28. Mills, G.; Jonsson, H. Phys. Rev. Lett. 1994, 72, 1124.
29. Didziulis, S. V.; Frantz, P.; Perry, S. S.; El-bjeirami, O.; Imaduddin, S.; Merrill, P. B. J. Phys. Chem. B 1999, 103, 11129.
30. Frantz, P.; Didziulis, S. V.; Fernandez-Torres, L. C.; Guenard, R. L.; Perry, S. S. J. Phys. Chem. B 2002, 706, 6456.
31. Rodriguez, J. A.; Liu, P.; Dvorak, J.; Jirsak, T.; Gomes, J.; Takahashi, Y.; Nakamura, K. Phys. Rev. B 2004, 69, 115414.
32. Guenard, R. L.; Fernandez-Torres, L. C.; Kim, B.; Perry, S. S.; Frantz, P.; Didziulis, S. V. Surf. Sci. 2002, 515, 103.