Steps on anatase TiO2(101).

作者: Xue-Qing Gong , Annabella Selloni , Matthias Batzill , Ulrike Diebold

DOI: 10.1038/NMAT1695

关键词: OxideChemical physicsNanotechnologyNanoparticleFacetAnataseQuantum tunnellingAdsorptionSurface energyMetalMaterials science

摘要: … and A is the exposed area of one side of the slab (the two sides of the slab are equivalent). We … Our results show a very close structure/reactivity relationship at the anatase surface: if the …

参考文章(41)
Xiaodong Zhang, Alexander A. Demkov, Steps on the (001) SrTiO3 surface Journal of Vacuum Science & Technology B. ,vol. 20, pp. 1664- 1670 ,(2002) , 10.1116/1.1496513
U. Diebold, N. Ruzycki, G.S. Herman, A. Selloni, One Step Towards Bridging the Materials Gap: Surface Studies of TiO2 Anatase Catalysis Today. ,vol. 85, pp. 93- 100 ,(2003) , 10.1016/S0920-5861(03)00378-X
Xue-Qing Gong, Annabella Selloni, Reactivity of Anatase TiO2Nanoparticles:  The Role of the Minority (001) Surface The Journal of Physical Chemistry B. ,vol. 109, pp. 19560- 19562 ,(2005) , 10.1021/JP055311G
F. P. Rotzinger, M. Grätzel, A. Vittadini, A. Selloni, Structure and Energetics of Water Adsorbed at TiO 2 Anatase \(101\) and \(001\) Surfaces Physical Review Letters. ,vol. 81, pp. 2954- 2957 ,(1998) , 10.1103/PHYSREVLETT.81.2954
Peter J. Feibelman, Ab initiostep and kink formation energies on Pb(111) Physical Review B. ,vol. 62, pp. 17020- 17025 ,(2000) , 10.1103/PHYSREVB.62.17020
C.C. Chusuei, X. Lai, K. Luo, D.W. Goodman, Modeling heterogeneous catalysts: metal clusters on planar oxide supports Topics in Catalysis. ,vol. 14, pp. 71- 83 ,(2000) , 10.1023/A:1009059100646
John P. Perdew, Kieron Burke, Matthias Ernzerhof, Generalized Gradient Approximation Made Simple Physical Review Letters. ,vol. 77, pp. 3865- 3868 ,(1996) , 10.1103/PHYSREVLETT.77.3865
Ulrike Diebold, The surface science of titanium dioxide Surface Science Reports. ,vol. 48, pp. 53- 229 ,(2003) , 10.1016/S0167-5729(02)00100-0
Ulrike Diebold, P. A. Cox, V. E. Henrich, The surface science of metal oxides ,(1994)