Article ID | Journal | Published Year | Pages | File Type |
---|---|---|---|---|
1561216 | Computational Materials Science | 2013 | 5 Pages |
Abstract
⺠First-principles study of the adsorption, diffusion and incorporation of Sc on the GaN(0 0 0 1) surface. ⺠The Sc incorporation process is energetically more favorable that the surface adsorption. ⺠The atomic Sc incorporation is more favorable in moderate and extreme N-rich conditions. ⺠DFT calculations predict the interface formation of ScN/GaN metal/semiconductor layer growth, before the Sc film formation.
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Authors
William López-Perez, Jairo Arbey Rodriguez, Rafael González-Hernández,