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Initial stage of Ag deposition on regular MgO(0 0 1) surface: A DFT study

✍ Scribed by Yu-Lin Hu; Wei-Bing Zhang; Yong-He Deng; Bi-Yu Tang


Book ID
116374882
Publisher
Elsevier Science
Year
2008
Tongue
English
Weight
768 KB
Volume
42
Category
Article
ISSN
0927-0256

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The chemisorption of one monolayer Ag atoms on an ideal Si(1 0 0) surface is studied by using the self-consistent tight-binding linear muffin-tin orbital method. The adsorption energies (E ad ) of different sites are calculated. It is found that the adsorbed Ag atoms are more favorable on C site (fo