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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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Detalhes bibliográficos
Publicado no:Sci Rep
Main Authors: Li, Jiao, Fan, Xinyu, Wei, Yanpei, Liu, Haiying, Li, Shujuan, Zhao, Peng, Chen, Gang
Formato: Artigo
Idioma:Inglês
Publicado em: Nature Publishing Group 2016
Assuntos:
Acesso em linha: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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