Why Au and Cu are more selective than Pt for preferential oxidation of CO at low temperature

Catalysis Letters

Volumn 93, Issue 1-2, 2004, Pages 93-100

  Kandoi, S , ^a   Gokhale, A A ^a   Grabow, L C ^a   Dumesic, J A ^a   Mavrikakis, M ^a  

^a University of Wisconsin Madison ^*  (United States)

Author keywords

Catalyst; CO oxidation; Copper; Density functional theory; Fuel cells; Gold; Hydrogen oxidation; Micro kinetic model; Platinum; Preferential oxidation; Selectivity

Indexed keywords

ACTIVATION ENERGY; CATALYST SELECTIVITY; COPPER; FUEL CELLS; GOLD; HYDROGEN; LOW TEMPERATURE OPERATIONS; OXIDATION; PLATINUM; PROBABILITY DENSITY FUNCTION; TEMPERATURE;

ACTIVATION ENERGY BARRIER; CARBON MONOXIDE OXIDATION; DENSITY FUNCTIONAL THEORY; ELEMENTARY REACTION STEPS; HYDROGEN OXIDATION; MICRO-KINETIC MODEL; PREFERENTIAL OXIDATION;

CARBON MONOXIDE;

EID: 1842685728     PISSN: 1011372X     EISSN: None     Source Type: Journal    
DOI: 10.1023/b:catl.0000016955.66476.44     Document Type: Article

References (61)

1. T.V. Choudhary and D.W. Goodman, Catal. Today 77 (2002) 65.
2. R.R. Davda and J.A. Dumesic, Angew. Chem. Int. Ed. 42 (2003) 4068.
3. O. Korotkikh and R. Farrauto, Catal. Today 62 (2000) 249.
4. H. Igarashi, H. Uchida, M. Suzuki, Y. Sasaki and M. Watanabe, Appl. Catal. A Gen. 159 (1997) 159.
5. M. J. Kahlich, H.A. Gasteiger and R.J. Behm, J. Catal. 171 (1997) 93.
6. M. Haruta, S. Tsubota, T. Kobayashi, H. Kageyama, M.J. Genet and B. Delmon, J. Catal. 144 (1993) 175.
7. B. Hammer and J.K. Nørskov, Nature 376 (1995) 238.
8. M. Mavrikakis, P. Stoltze and J.K. Nørskov, Catal. Lett. 64 (2000) 101.
9. Z.P. Liu, P. Hu and A. Alavi, J. Am. Chem. Soc. 124 (2002) 14770.
10. N. Lopez and J.K. Nørskov, J. Am. Chem. Soc. 124 (2002) 11262.
11. V.A. Bondzie, S.C. Parker and C.T. Campbell, Catal. Lett. 63 (1999) 143.
12. C.K. Costello, M.C. Kung, H.S. Oh, Y. Wang and H.H. Kung, Appl. Catal. A Gen. 232 (2000) 159.
13. H.H. Kung, M.C. Kung and C.K. Costello, J. Catal. 216 (2003) 425.
14. L.M. Molina and B. Hammer, Phys. Rev. Lett. 90 (2003).
15. M. Valden, X. Lai and D.W. Goodman, Science 281 (1998) 1647.
16. F. Boccuzzi, A. Chiorino, S. Tsubota and M. Haruta, J. Phys. Chem.-Us 100 (1996) 3625.
17. A. Cho, Science 299 (2003) 1684.
18. D. Cameron, R. Holliday and D. Thompson, J. Power Sources 118 (2003) 298.
19. T.V. Choudhary and D.W. Goodman, Top. Catal. 21 (2002) 25.
20. R.M.T. Sanchez, A. Ueda, K. Tanaka and M. Haruta, J. Catal. 168 (1997) 125.
21. R.J.H. Griesel and B.E. Niewenhuys, J. Catal. 199 (2001) 48.
22. M.J. Kahlich, H.A. Gasteiger and R.J. Behm, J. Catal. 182 (1999) 430.
23. G.K. Bethke and H.H. Kung, Appl. Catal. A Gen. 194 (2000) 43.
24. T.V. Choudhary, S. Sivadinarayana, C. Chusuei, A.K. Datye, J.P. Fackler Jr and D.W. Goodman, J. Catal. 207 (2002) 247.
25. M.M. Schubert, V. Plzak, J. Garche and R.J. Behm, Catal. Lett. 76 (2001) 143.
26. G. Avgouropoulos, T. Ionnides, C. Papadopoulou, J. Batista, S. Hocevar and H.K. Matralis, Catal. Today 75 (2002) 157.
27. G. Avgouropoulos, T. Ioannides, H.K. Matralis, J. Batista and S. Hocevar, Catal. Lett. 73 (2001) 33.
28. D.H. Kim and J.E. Chua, Catal. Lett. 86 (2003) 107.
29. M.M. Schubert, M.J. Kahlich, G. Feldmeyer, M. Huttner, S. Hackenberg, H.A. Gasteiger and R.J. Behm, Phys. Chem. Chem. Phys. 3 (2001) 1123.
30. J. Zhang, Y. Wang, B. Chen, C. Li, D. Wu and X. Wang, Energy Conv. Mgmt. 44 (2003) 1805.
31. P.V. Snytnikov, V.A. Sobyanin, V.D. Belyaev, P.G. Tsyrulnukov, N.B. Shitova and D.A. Shlyapin, Appl. Catal. A Gen. 239 (2003) 149.
32. H. Tanaka, S. Ito, S. Kameoka, K. Tomishige and K. Kunimori, Catal. Commun. 4 (2003) 1.
33. J. Greeley, J.K. Nørskov and M. Mavrikakis, Ann. Rev. Phys. Chem. 53 (2002) 319.
34. B. Hammer, L.B. Hansen and J.K. Nørskov, Phys. Rev. B 59 (1999) 7413.
35. J. Neugebauer and M. Scheffler, Phys. Rev. B 46 (1992) 16067.
36. A. Michaelides and P. Hu, J. Am. Chem. Soc. 122 (2000) 9866.
37. A. Michaelides and P. Hu, J. Am. Chem. Soc. 123 (2001) 4235.
38. Y. Xu and M. Mavrikakis, Surf. Sci. 494 (2001) 131.
39. Y. Xu and M. Mavrikakis, J. Phys. Chem. B 107 (2003) 9298.
40. J. Greeley and M. Mavrikakis, J. Am. Chem. Soc. 124 (2002) 7193.
41. D. Vanderbilt, Phys. Rev. B 41 (1990) 7892.
42. J.P. Perdew, J.A. Chevary, S.H. Vosko, K.A. Jackson, M.R. Pederson, D.J. Singh and C. Fiolhais, Phys. Rev. B 46 (1992) 6671.
43. J.A. White and D.M. Bird, Phys. Rev. B 50 (1994) 4954.
44. G. Kresse and J. Furthmuller, Comput. Mater. Sci. 6 (1996) 15.
45. CRC Handbook of Chemistry and Physics, 76th edn., ed. D.R. Lide (CRC Press, New York, 1996).
46. J. Greeley and M. Mavrikakis, J. Catal. 208 (2002) 291.
47. J. Greeley, A.A. Gokhale, J. Kreuser, J.A. Dumesic, H. Topsoe, N.Y. Topsoe and M. Mavrikakis, J. Catal. 213 (2003) 63.
48. Y. Xu and M. Mavrikakis, Surf. Sci. 538 (2003) 219.
49. G. Henkelman, B.P. Uberuaga and H. Jonsson, J. Chem. Phys. 113 (2000) 9901.
50. G. Henkelman and H. Jonsson, J. Chem. Phys. 113 (2000) 9978.
51. J. Greeley and M. Mavrikakis, Surf. Sci. 540 (2003) 215.
52. J.A. Dumesic, The Microkinetics of Heterogeneous Catalysis. ACS professional reference book. Vol. XII (American Chemical Society, Washington, DC, 1993).
53. P.J. Linstrom and W.G. Mallard, eds. NIST Chemistry WebBook, NIST Standard Reference Database Number 69 (National Institute of Standards and Technology, Gaithersburg MD, 2003) (http://webbook.nist.gov).
54. W.E. Stewart, M. Caracotsios and J.P. Sorensen, AIChE J. 38 (1992) 641.
55. A. Michaelides, V.A. Ranea, P.L. de Andres and D.A. King, Phys. Rev. Lett. 90 (2003) 216102.
56. A. Eichler, Surf. Sci. 498 (2002) 314.
57. C.J. Zhang, R.J. Baxter, P. Hu, A. Alavi and M.H. Lee, J. Chem. Phys. 115 (2001) 5272.
58. M. Mavrikakis, M. Bäumer, H.J. Freund and J.K. Nørskov, Catal. Lett. 81 (2002) 153.
59. S. Dahl, A. Logadottir, R.C. Egeberg, J.H. Larsen, I. Chorkendorff, E. Tornqvist and J.K. Nørskov, Phys. Rev. Lett. 83 (1999) 1814.
60. J.K. Nørskov, et al., J. Catal. 209 (2002) 275.
61. M.M. Schubert, M.J. Kahlich, H.A. Gasteiger and R.J. Behm, J. Power Sources 84 (1999) 175.