Surface adsorption and diffusion of N on γ-Fe–Al (111) using first principles calculations
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DOI: 10.1007/s42243-018-0205-1
Abstract: The adsorption and diffusion of N on γ-Fe–Al (111) surface have been investigated using the first principle calculations combined with density functional theory to explore the formation mechanism of AlN in the oxidation process of… read more here.
Keywords: surface; using first; diffusion 111; adsorption ... See more keywords
Steric Hindrance of NH3 Diffusion on Pt(111) by Co-Adsorbed O-Atoms
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DOI: 10.1021/jacs.2c10458
Abstract: A detailed velocity-resolved kinetics study of NH3 thermal desorption rates from p(2 × 2) O/Pt(111) is presented. We find a large reduction in the NH3 desorption rate due to adsorption of O-atoms on Pt(111). A… read more here.
Keywords: diffusion; adsorbed atoms; hindrance nh3; diffusion 111 ... See more keywords