Electronic and magnetic properties of doped black phosphorene with concentration dependence

In this paper, we employed first-principles calculations and chose Si and S atoms as impurities to explore the concentration-dependence of electronic structure and magnetism of doped phosphorene. It is found that the stability of doped phosphorene improves continuously with increasing the supercell...

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Bibliographic Details
Main Authors: Ke Wang, Hai Wang, Min Zhang, Yan Liu, Wei Zhao
Format: Article
Language:English
Published: Beilstein-Institut 2019-05-01
Series:Beilstein Journal of Nanotechnology
Subjects:
Online Access:https://doi.org/10.3762/bjnano.10.100