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Half-metallicity and ferromagnetism in penta-AlN(2) nanostructure

We have performed a detailed first-principles study of the penta-AlN(2) nanostructure in the Cairo pentagonal tiling geometry, which is dynamically stable due to the absence of imaginary mode in the calculated phonon spectrum. The formation energy and the fragment cohesive energy analyses, the molec...

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Detalles Bibliográficos
Publicado en:Sci Rep
Main Authors: Li, Jiao, Fan, Xinyu, Wei, Yanpei, Liu, Haiying, Li, Shujuan, Zhao, Peng, Chen, Gang
Formato: Artigo
Idioma:Inglês
Publicado: Nature Publishing Group 2016
Assuntos:
Acceso en liña:https://ncbi.nlm.nih.gov/pmc/articles/PMC5018739/
https://ncbi.nlm.nih.gov/pubmed/27616459
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1038/srep33060
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