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Generalized-stacking-fault energy and surface properties for HCP metals: A first-principles study

✍ Scribed by Xiaozhi Wu; Rui Wang; Shaofeng Wang

Publisher: Elsevier Science
Year: 2010
Tongue: English
Weight: 273 KB
Volume: 256
Category: Article
ISSN: 0169-4332
DOI: 10.1016/j.apsusc.2009.12.042

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## Abstract A theoretical study of CH~3~ adsorbed on the (111) surface of some transition and noble metal surfaces M (M = Cu, Ni, Rh, Pt, Pd, Ag, Au) and on the Fe(100) is presented. We find that the hollow site is preferred more than the top one for Fe, Ni, Rh, and Cu, but it is the other way for