Abstract
Abstract The effect of ZnO substrate on the structural and electronic properties of blue phosphorene were systematically investigated by first-principles calculations. The results show the band gaps of heterostructures are narrow than pure states and can be tuned sensitive by electric field. Zn pattern heterostructure is dynamically stable. In addition, EΓ and band gap can be tuned flexible which is reducing as strain increase and the structures turn from semiconductor to metal by compressive strain increasing, the optical properties indicate the optical absorption peak of the material is in the visible and ultraviolet region.
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