自旋电子学
凝聚态物理
多铁性
材料科学
范德瓦尔斯力
铁磁性
异质结
磁各向异性
铁电性
磁场
物理
磁化
电介质
光电子学
量子力学
分子
作者
Luqian Fu,Xiaocha Wang,Wenbo Mi
标识
DOI:10.1002/adts.202100302
摘要
Abstract 2D van der Waals (vdW) multiferroic heterostructures have potential applications in novel 2D spintronic devices. Here, the electronic structure and magnetic anisotropy of 2D vdW multiferroic Mn 2 CFCl/CuBiP 2 Se 6 heterostructures are investigated systematically by first‐principles calculations. Ferroelectric material CuBiP 2 Se 6 has a built‐in electric field. Mn 2 CFCl is a half‐metallicity with ferromagnetic. The plane average potential difference of Mn 2 CFCl/CuBiP 2 Se 6 heterostructures is 0.02 eV in P↓ state and 0.39 eV in P↑ state. The magnetic anisotropy of P↑ and P↓ states is shown perpendicular magnetic anisotropy (PMA). The P↑ state exhibits metallic character with the biaxial strain of 4%, −6%, while the P↓ state demonstrates half‐metallicity at a strain of 2%, 4%, 6%. The P↑ state shows PMA at the different biaxial strain. However, the P↓ state shows PMA at biaxial strain of −2%, −4%, and 6%, which shifts PMA to in‐plane magnetic anisotropy at −6%, 2%, and 4%. These tunable electronic structure and magnetic anisotropy suggest that the 2D multiferroic Mn 2 CFCl/CuBiP 2 Se 6 vdW heterostructures have potential applications in spintronic devices.
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