A density-functional study of the energetics of H2O dissociation on bimetallic Pt/Ru nanoclusters

Chemical Physics Letters

Volumn 411, Issue 4-6, 2005, Pages 404-410

  Ishikawa, Yasuyuki ^a   Diaz Morales, Robert R ^a   Perez, Alejandro ^a   Vilkas, Marius J ^a   Cabrera, Carlos R ^a  

^a UNIVERSITY OF PUERTO RICO   (Puerto Rico)

Author keywords

[No Author keywords available]

Indexed keywords

ACTIVATION ANALYSIS; DISSOCIATION; HYDROGENATION; MORPHOLOGY; PROBABILITY DENSITY FUNCTION; SURFACES;

ACTIVATION BARRIERS; ENERGETICS; HOMOLYTIC BONDS; NANOCLUSTERS;

NANOSTRUCTURED MATERIALS;

EID: 22944466919     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cplett.2005.05.128     Document Type: Article

References (30)

1. T. Iwasita, F.C. Nart, and W. Vielstich Ber. Bunsenges. Phys. Chem. 94 1990 1021
2. H. Ogasawara, J. Yoshinobu, and M. Kawai Surf. Sci. 386 1997 73
3. J. Bergeld, B. Kasemo, and D.V. Chakarov Surf. Sci. 495 2001 L815
4. E. Ticanelli, J.G. Beery, M.T. Paffett, and S. Gottesfeld J. Electroanal. Chem. 258 1989 61
5. F.J. Rodriguez-Nieto, T.Y. Morante-Catacora, and C.R. Cabrera J. Electroanal. Chem. 571 2004 15
6. M. Watanabe, and S. Motoo J. Electroanal. Chem. 60 1975 275
7. H.A. Gasteiger, N.M. Markovic, P.N. Ross Jr., and E.J. Cairns J. Phys. Chem. 98 1994 617
8. R. Ianniello, V.M. Schmidt, U. Stimming, J. Stumper, and A. Wallau Electrochim. Acta 39 1994 1863
9. Y. Ishikawa, M.-S. Liao, and C.R. Cabrera Surf. Sci. 463 2000 66
10. Y. Ishikawa, M.-S. Liao, and C. Cabrera Surf. Sci. 513 2002 98
11. J. Greeley, and M. Mavrikakis J. Am. Chem. Soc. 124 2002 7193
12. S.K. Desai, M. Neurock, and K. Kourtakis J. Phys. Chem. B 106 2002 2559
13. A.B. Anderson, and E. Grantscharova J. Phys. Chem. 99 1995 9149
14. A.B. Anderson, E. Grantscharova, and S. Seong J. Electrochem. Soc. 143 1996 2075
15. A.B. Anderson, N.M. Neshev, R.A. Sidik, and P. Shiller Electrochim. Acta 47 2002 2999
16. S. Desai, and M. Neurock Electrochim. Acta 48 2003 3759
17. T.E. Shubina, and M.T.M. Koper Electrochim. Acta 47 2002 3621
18. M.T.M. Koper, T.E. Shubina, and R.A. van Santen J. Phys. Chem. B 106 2002 686
19. W. Chrzanowski, and A. Wieckowski Langmuir 14 1998 1967
20. W.F. Lin, M.S. Zei, M. Eiswirth, G. Ertl, T. Iwasita, and W. Vielstich J. Phys. Chem. B 103 1999 6968
21. J.C. Davies, B.E. Hayden, D.J. Pegg, and M.E. Rendall Surf. Sci. 496 2002 110
22. B. Delley J. Chem. Phys. 113 2000 7756
23. J.P. Perdew, K. Burke, and M. Ernzerhof Phys. Rev. Lett. 77 1996 3865
24. B. Delley Int. J. Quantum Chem. 69 1998 423
25. B.I. Dunlap, and N. Rösch Adv. Quantum Chem. 21 1990 317
26. H. Sellers, E.M. Pattrito, and P. Paredes-Olivera Surf. Sci. 418 1998 376
27. B.A. Sexton, and A.E. Hughes Surf. Sci. 140 1984 227
28. Michaelides, V.A. Ranea, P.L. de Andres, and D.A. King Phys. Rev. Lett. 90 2003 216102
29. E. Shustorovich, and H. Sellers Surf. Sci. Rep. 31 1998 1
30. Y. Wang, and P.B. Balbuena J. Phys. Chem. B 108 2004 4376