Effects of coordination number of Au catalyst on oxygen species and their catalytic roles

Applied Surface Science

Volumn 387, Issue , 2016, Pages 875-881

  Ouyang, Gen ^a   Zhu, Kong Jie ^a   Zhang, Lei ^a   Cui, Peng Fei ^a   Teng, Bo Tao ^a   Wen, Xiao Dong ^b  

^a ZHEJIANG NORMAL UNIVERSITY   (China)

^b INSTITUTE OF COAL CHEMISTRY   (China)

Author keywords

Coordination number; Density functional theory; Gold catalysis; Oxygen species

Indexed keywords

ADATOMS; CATALYSIS; GAS ADSORPTION; GOLD NANOPARTICLES; OXYGEN;

COORDINATION NUMBER; ELEY-RIDEAL MECHANISM; GOLD CATALYSIS; OXIDATION ACTIVITIES; OXYGEN ADSORPTION; OXYGEN SPECIES; QUANTITATIVE CORRELATION; SYSTEMATIC STUDY;

DENSITY FUNCTIONAL THEORY;

EID: 84989896861     PISSN: 01694332     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.apsusc.2016.07.027     Document Type: Article

References (35)

1. [1] Haruta, M., Yamada, N., Kobayashi, T., Iijima, S., J. Catal. 115 (1989), 301–309.
2. [2] Hashmi, A.S.K., Hutchings, G.J., Angew. Chem. Int. Ed. 45 (2006), 7896–7936.
3. [3] Chrétien, S., Buratto, S.K., Metiu, H., Curr. Opin. Solid State Mater. 11 (2007), 62–75.
4. [4] Fajin, J.L.C., Cordeiro, M.N.D.S., Gomes, J.R.B., J. Catal. 289 (2012), 11–20.
5. [5] Pyykkö, P., Angew. Chem. Int. Ed. 43 (2004), 4412–4456.
6. [6] Widmann, D., Behm, R.J., Acc. Chem. Res. 47 (2014), 740–749.
7. [7] Wu, Z., Jin, Y., Xu, L., Yuan, Q., Xiong, F., Jiang, Z., Huang, W., J. Phys. Chem. C 118 (2014), 8397–8405.
8. [8] Wu, Z., Xu, L., Zhang, W., Ma, Y., Yuan, Q., Jin, Y., Yang, J., Huang, W., J. Catal. 304 (2013), 112–122.
9. [9] Bukhtiyarov, A.V., Kvon, R.I., Nartova, A.V., Prosvirin, I.P., Bukhtiyarov, V.I., Surf. Sci. 606 (2012), 559–563.
10. [10] Gong, J., Flaherty, D.W., Ojifinni, R.A., White, J.M., Mullins, C.B., J. Phys. Chem. C 112 (2008), 5501–5509.
11. [11] McClure, S.M., Kim, T.S., Stiehl, J.D., Tanaka, P.L., Mullins, C.B., J. Phys. Chem. B 108 (2004), 17952–17958.
12. [12] Wu, Z., Ma, Y., Zhang, Y., Xu, L., Chen, B., Yuan, Q., Huang, W., J. Phys. Chem. C 116 (2012), 3608–3617.
13. [13] Fajín, J.L.C., Cordeiro, M.N.D.S., Gomes, J.R.B., J. Phys. Chem. C 111 (2007), 17311–17321.
14. [14] Torres, D., González, S., Neyman, K.M., Illas, F., Chem. Phys. Lett. 422 (2006), 412–416.
15. [15] Lopez, N., Garcia-Mota, M., Gomez-Diaz, J., J. Phys. Chem. C 112 (2008), 247–252.
16. [16] Xu, B., Haubrich, J., Baker, T.A., Kaxiras, E., Friend, C.M., J. Phys. Chem. C 115 (2011), 3703–3708.
17. [17] Zhang, W., Li, Z., Luo, Y., Yang, J., J. Chem. Phys., 129, 2008, 134708.
18. [18] Mills, G., Gordon, M.S., Metiu, H., Chem. Phys. Lett. 359 (2002), 493–499.
19. [19] Xu, Y., Mavrikakis, M., J. Phys. Chem. B 107 (2003), 9298–9307.
20. [20] Segall, M.D., Lindan, P.J.D., Probert, M.J., Pickard, C.J., Hasnip, P.J., Clark, S.J., Payne, M.C., J. Phys. Condens. Mater, 14, 2002, 2717.
21. [21] Payne, M.C., Teter, M.P., Allan, D.C., Arias, T.A., Joannopoulos, J.D., Rev. Mod. Phys. 64 (1992), 1045–1097.
22. [22] Milman, V., Winkler, B., White, J.A., Pickard, C.J., Payne, M.C., Akhmatskaya, E.V., Nobes, R.H., Int. J. Quantum Chem. 77 (2000), 895–910.
23. [23] Perdew, J.P., Burke, K., Ernzerhof, M., Phys. Rev. Lett. 77 (1996), 3865–3868.
24. [24] Hammer, B., Hansen, L.B., Nørskov, J.K., Phys. Rev. B 59 (1999), 7413–7421.
25. [25] Vanderbilt, D., Phys. Rev. B 41 (1990), 7892–7895.
26. [26] Monkhorst, H.J., Pack, J.D., Phys. Rev. B, 13, 1976, 5188.
27. [27] Halgren, T.A., Lipscomb, W.N., Chem. Phys. Lett. 49 (1977), 225–232.
28. [28] Govind, N., Petersen, M., Fitzgerald, G., King-Smith, D., Andzelm, J., Comput. Mater. Sci. 28 (2003), 250–258.
29. [29] Ji, M., Hao, C., Xie, Z., Liu, S., Qiu, J., J. Comput. Theor. Nanosci. 9 (2012), 394–400.
30. [30] Santiago-Rodríguez, Y., Herron, J.A., Curet-Arana, M.C., Mavrikakis, M., Surf. Sci. 627 (2014), 57–69.
31. [31] Vinod, C.P., Niemantsverdriet Hans, J.W., Nieuwenhuys, B.E., Appl. Catal. A 291 (2005), 93–97.
32. [32] Choudhary, T.V., Goodman, D.W., Appl. Catal. A 291 (2005), 32–36.
33. [33] Mills, G., Gordon, M.S., Metiu, H., J. Chem. Phys. 118 (2003), 4198–4205.
34. [34] Liu, Z.-P., Hu, P., Alavi, A., J. Am. Chem. Soc. 124 (2002), 14770–14779.
35. [35] Molina, L.M., Hammer, B., Appl. Catal. A 291 (2005), 21–31.