A density functional study of the adsorption of CO on Rh(111)

Physical Chemistry Chemical Physics

Volumn 4, Issue 21, 2002, Pages 5372-5376

  Curulla, D ^a   Linke, R ^a   Clotet, A ^b   Ricart, J M ^b   Niemantsverdriet, J W ^a  

^a EINDHOVEN UNIVERSITY OF TECHNOLOGY   (Netherlands)

^b UNIVERSITAT ROVIRA I VIRGILI   (Spain)

Author keywords

[No Author keywords available]

Indexed keywords

RHENIUM;

ADSORPTION; ARTICLE; CALCULATION; CATALYST; CRYSTAL STRUCTURE; DENSITY;

EID: 0036979960     PISSN: 14639076     EISSN: None     Source Type: Journal    
DOI: 10.1039/b206692k     Document Type: Article

References (28)

1. D. G. Castner, B. A. Sexton and G. A. Somorjai, Surf. Sci., 1978, 71, 519.
2. D. H. Wei, D. C. Skelton and S. D. Kewan, Surf. Sci., 1997, 381, 49.
3. R. Linke, D. Curulla, M. J. P. Hopstaken and J. W. Niemants-verdriet, J. Chem. Phys., 2001, 115, 8209.
4. P. A. Thiel, E. D. Williams, J. T. Yates, Jr. and W. H. Weinberg, Surf. Sci., 1979, 84, 54.
5. M. A. van Hove, R. J. Koetsner, J. C. Frost and G. A. Somorjai, Surf. Sci., 1983, 129, 482.
6. M. Gierer, A. Barbieri, M. A. van Hove and G. A. Somorjai, Surf. Sci., 1997, 391, 176.
7. L. H. Dubois and G. A. Somorjai, Surf. Sci., 1980, 91, 514.
8. A. Beutler, E. Lundgren, R. Nyholm, J. N. Andersen, B. Setlik and D. Heskett, Surf. Sci., 1997, 371, 381.
9. A. Beutler, E. Lundgren, R. Nyholm, J. N. Andersen, B. Setlik and D. Heskett, Surf. Sci., 1998, 396, 117.
10. E. Lundgren, X. Torrelles, J. Alvarez, S. Ferrer, H. Over, A. Beutler and J. N. Andersen, Phys. Rev. B, 1999, 59, 5876.
11. P. Cernota, K. Rider, H. A. Yoon, M. Salmeron and G. Somorjai, Surf. Sci., 2000, 445, 249.
12. D. Curulla, R. Linke, A. Clotet, J. M. Ricart and J. W. Niemantsverdriet, Chem. Phys. Lett., 2002, 354, 503.
13. A. Eichler and J. Hafner, J. Chem. Phys., 1998, 109, 5585.
14. A. Goursot, I. Papai and D. R. Salahub, J. Am. Chem. Soc., 1992, 114, 7452.
15. D. Majumdar and K. Balasubramanian, J. Chem. Phys., 1997, 106, 7215.
16. C. J. Zhang, P. Hu and M.-H. Lee, Surf. Sci., 1999, 432, 305.
17. A. M. de Jong and J. W. Niemantsverdriet, J. Chem. Phys., 1994, 101, 10126.
18. B. A. Gurney, L. J. Richter, J. S. Villarubia and W. Ho, J. Chem. Phys., 1987, 87, 6710.
19. L. J. Richter, B. A. Gurney and W. Ho, J. Chem. Phys., 1987, 86, 477.
20. D. Curulla, A. Clotet and J. M. Ricart, Surf. Sci., 2000, 460, 101.
21. H. P. Singh, Acta Crystallogr., Sect. A, 1968, 24, 469.
22. P. Hay and W. R. Wadt, J. Chem. Phys., 1985, 82, 299.
23. A. D. Becke, J. Chem. Phys., 1993, 98, 5648.
24. M. J. Frisch et al., Gaussian 98, Revision A.6, Gaussian, Inc., Pittsburgh PA, 1998.
25. J. D. Head, Int. J. Quantum Chem., 1997, 65, 827.
26. C. J. Nelin, P. S. Bagus and M. R. Philpott, J. Chem. Phys., 1987, 87, 2170.
27. D. Curulla, A. Clotet, J. M. Ricart and F. Illas, J. Phys. Chem. B, 1999, 103, 5246.
28. R. M. Hammaker, S. A. Francis and R. P. Eischens, Spectrochim. Acta, 1965, 21, 1295.