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Unexpected electronic structure of the alloyed and doped arsenene sheets: First-Principles calculations

We study the equilibrium geometry and electronic structure of alloyed and doped arsenene sheets based on the density functional theory calculations. AsN, AsP and SbAs alloys possess indirect band gap and BiAs is direct band gap. Although AsP, SbAs and BiAs alloyed arsenene sheets maintain the semico...

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Publicado en:Sci Rep
Main Authors: Liu, Ming-Yang, Huang, Yang, Chen, Qing-Yuan, Cao, Chao, He, Yao
Formato: Artigo
Idioma:Inglês
Publicado: Nature Publishing Group 2016
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Acceso en liña:https://ncbi.nlm.nih.gov/pmc/articles/PMC4931469/
https://ncbi.nlm.nih.gov/pubmed/27373712
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1038/srep29114
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