Adsorption-induced step formation

被引:54
作者
Thostrup, P
Christoffersen, E
Lorensen, HT
Jacobsen, KW
Besenbacher, F [1 ]
Norskov, JK
机构
[1] Aarhus Univ, Inst Phys & Astron, CAMP, DK-8000 Aarhus, Denmark
[2] Tech Univ Denmark, Dept Phys, CAMP, DK-2800 Lyngby, Denmark
[3] Tech Univ Denmark, Interdisciplinary Res Ctr Catalysis, DK-2800 Lyngby, Denmark
关键词
D O I
10.1103/PhysRevLett.87.126102
中图分类号
O4 [物理学];
学科分类号
0702 ;
摘要
Through an interplay between density functional calculations, Monte Carlo simulations and scanning tunneling microscopy experiments, we show that an intermediate coverage of CO on the Pt(110) surface gives rise to a new rough equilibrium structure with more than 50% step atoms. CO is shown to bind so strongly to low-coordinated Pt atoms that it can break Pt-Pt bonds and spontaneously form steps on the surface. It is argued that adsorption-induced step formation may be a general effect, in particular at high gas pressures and temperatures.
引用
收藏
页码:1 / 126102
页数:4
相关论文
共 22 条
[1]   VIBRATIONAL STUDIES OF THE SURFACE PHASES OF CO ON PT(110) AT 300-K [J].
BARE, SR ;
HOFMANN, P ;
KING, DA .
SURFACE SCIENCE, 1984, 144 (2-3) :347-369
[2]   THE EQUILIBRIUM CRYSTAL SHAPE AND THE ROUGHENING TRANSITION ON METAL-SURFACES [J].
CONRAD, EH ;
ENGEL, T .
SURFACE SCIENCE, 1994, 299 (1-3) :391-404
[3]   Ordering of self-diffusion barrier energies on Pt(110)-(1x2) [J].
Feibelman, PJ .
PHYSICAL REVIEW B, 2000, 61 (04) :R2452-R2455
[4]  
FEIBELMAN PJ, IN PRESS
[5]   STRUCTURE DETERMINATION OF THE (1X2) AND (1X3) RECONSTRUCTIONS OF PT(110) BY LOW-ENERGY ELECTRON-DIFFRACTION [J].
FERY, P ;
MORITZ, W ;
WOLF, D .
PHYSICAL REVIEW B, 1988, 38 (11) :7275-7286
[6]   MECHANISM OF THE CO-INDUCED 1X2-]1X1 STRUCTURAL TRANSFORMATION OF PT(110) [J].
GRITSCH, T ;
COULMAN, D ;
BEHM, RJ ;
ERTL, G .
PHYSICAL REVIEW LETTERS, 1989, 63 (10) :1086-1089
[7]   Improved adsorption energetics within density-functional theory using revised Perdew-Burke-Ernzerhof functionals [J].
Hammer, B ;
Hansen, LB ;
Norskov, JK .
PHYSICAL REVIEW B, 1999, 59 (11) :7413-7421
[8]   Adsorbate reorganization at steps: NO on Pd(211) [J].
Hammer, B ;
Norskov, JK .
PHYSICAL REVIEW LETTERS, 1997, 79 (22) :4441-4444
[9]   Structure sensitivity in adsorption: CO interaction with stepped and reconstructed Pt surfaces [J].
Hammer, B ;
Nielsen, OH ;
Norskov, JK .
CATALYSIS LETTERS, 1997, 46 (1-2) :31-35
[10]   The NO plus CO reaction catalyzed by flat, stepped, and edged Pd surfaces [J].
Hammer, B .
JOURNAL OF CATALYSIS, 2001, 199 (02) :171-176