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Insights into the structural, electronic and magnetic properties of V-doped copper clusters: comparison with pure copper clusters
The structural, electronic and magnetic properties of Cu(n+1) and Cu(n)V (n = 1–12) clusters have been investigated by using density functional theory. The growth behaviors reveal that V atom in low-energy Cu(n)V isomer favors the most highly coordinated position and changes the geometry of the thre...
| Autores principales: | , , , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
Nature Publishing Group
2016
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4989221/ https://www.ncbi.nlm.nih.gov/pubmed/27534599 http://dx.doi.org/10.1038/srep31978 |