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Energetics and Electronic Structure of h-BN Nanoflakes
We studied the energetics and electronic structure of hexagonal boron nitride (h-BN) nanoribbons with hydrogenated and clean edges with respect to the detailed edge shapes using density functional theory. Our calculations showed that the stability of h-BN edges strongly depends on the edge terminati...
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| Publicado no: | Sci Rep |
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| Main Authors: | , |
| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
Nature Publishing Group
2016
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| Assuntos: | |
| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC4969744/ https://ncbi.nlm.nih.gov/pubmed/27481626 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1038/srep30653 |
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