The structure of formate species on Pd(111) calculated by density functional theory and determined using low energy electron diffraction

2005 ◽  
Vol 574 (2-3) ◽  
pp. 166-174 ◽  
Author(s):  
T. Zheng ◽  
D. Stacchiola ◽  
D.K. Saldin ◽  
J. James ◽  
D.S. Sholl ◽  
...  
Keyword(s):  
Density Functional Theory ◽  
Electron Diffraction ◽  
Density Functional ◽  
Low Energy ◽  
Energy Electron ◽  
Functional Theory ◽  
Low Energy Electron Diffraction ◽  
Low Energy Electron

The (100) surface of the Al13Co4 quasicrystalline approximant

2012 ◽  
Vol 1517 ◽  
Author(s):  
Vincent Fournée ◽  
Émilie Gaudry ◽  
Marie-Cécile de Weerd ◽  
Renee D. Diehl ◽  
Julian Ledieu
Keyword(s):  
Density Functional Theory ◽  
Electron Diffraction ◽  
Density Functional ◽  
Low Energy ◽  
Scanning Tunneling ◽  
Tunneling Microscopy ◽  
Functional Theory ◽  
Low Energy Electron Diffraction ◽  
Surface Models ◽  
Low Energy Electron

ABSTRACTThe structure of the (100) surface of the orthorhombic Al13Co4quasicrystalline approximant is described based on a combined scanning tunneling microscopy (STM), low-energy electron diffraction (LEED), and density functional theory (DFT) study. We discuss the interplay between the surface structure and the cluster substructure of this approximant as well as possible off-stoichiometry effects that could explain the discrepancies found in the literature on possible surface models.

Low-Energy-Electron-Diffraction Structural Studies of (100) Cleavage Surfaces of In4Se3 Layered Crystals

2014 ◽  
Vol 59 (6) ◽  
pp. 612-621 ◽  
Author(s):  
P.V. Galiy ◽  
◽  
Ya.B. Losovyj ◽  
T.M. Nenchuk ◽  
I.R. Yarovets’ ◽  
...  
Keyword(s):  
Electron Diffraction ◽  
Low Energy ◽  
Energy Electron ◽  
Structural Studies ◽  
Low Energy Electron Diffraction ◽  
Layered Crystals ◽  
Low Energy Electron
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