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Electric-field induced half-metallic properties in an experimentally synthesized CrSBr monolayer.

Hao-Tian GuoSan-Dong GuoYee Sin Ang
Published in: Physical chemistry chemical physics : PCCP (2023)
Two-dimensional (2D) half-metallic materials are highly desirable for nanoscale spintronic applications. Here, we propose a new mechanism that can achieve half-metallicity in 2D ferromagnetic (FM) materials with two-layer magnetic atoms by electric field tuning. We use a concrete example of an experimentally synthesized CrSBr monolayer to illustrate our proposal through first-principles calculations. It is found that half-metallic properties can be achieved in CrSBr within an appropriate electric field range, and the corresponding amplitude of electric field intensity can be realized experimentally. Janus monolayer Cr 2 S 2 BrI is constructed, which possesses a built-in electric field due to broken horizontal mirror symmetry. However, Cr 2 S 2 BrI without and with an applied external electric field is always a FM semiconductor. A possible memory device is also proposed based on the CrSBr monolayer. Our work will stimulate the application of 2D FM CrSBr in future spintronic nanodevices.
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