Ab initio study of structural, electronic and magnetic properties of iron clusters Fe n (n=2-13)
Structures, binding energies, and magnetic moments of Fe n (n = 2-13) clusters have been obtained by pseudopotential density functional theory. A Troullier-Martin scheme was used to generate the iron's pseudopotential and we have successfully reproduced results (lattice constant and magnetic moment)...
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| Veröffentlicht in: | Revista Mexicana de Física |
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| Hauptverfasser: | , |
| Format: | Artigo |
| Sprache: | Inglês |
| Veröffentlicht: |
Sociedad Mexicana de Física A.C.
2011
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| Schlagworte: | |
| Online-Zugang: | https://www.redalyc.org/articulo.oa?id=57019378012 |
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