Title of article :
Stability of fcc (1 1 0) transition and noble metal surfaces
Author/Authors :
Vitos، نويسنده , , L and Johansson، نويسنده , , B and Skriver، نويسنده , , H.L and Kollلr، نويسنده , , J، نويسنده ,
Issue Information :
روزنامه با شماره پیاپی سال 2000
Pages :
4
From page :
156
To page :
159
Abstract :
We have used density functional theory in conjunction with the full charge density linear muffin-tin orbitals method and a cluster expansion based on interatomic pair potentials to derive the energetics of vicinal surfaces on transition and noble metals, and we apply the results in a study of the stability of the fcc (1 1 0) facet of these metals against the formation of `rippledʹ surfaces consisting of vicinal facets with Miller indices (2λ+1,2λ+1,1) and (2λ+1,2λ+1,1̄).
Keywords :
surface energy , Density functional calculation , Vicinal surface , surface reconstruction
Journal title :
Computational Materials Science
Serial Year :
2000
Journal title :
Computational Materials Science
Record number :
1678445
Link To Document :
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