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High-Curie-temperature ferromagnetism in bilayerCrI3on bulk semiconducting substrates
Physical Review Materials ( IF 3.4 ) Pub Date : 2020-09-15 , DOI: 10.1103/physrevmaterials.4.094003
Nanshu Liu , Si Zhou , Jijun Zhao

Two-dimensional (2D) ferromagnetic (FM) semiconductors with high Curie temperature have long been pursued for electronic and spintronic applications. Here we provide a general strategy to achieve robust FM state in bilayer CrI3 of the monoclinic stacking, which intrinsically has interlayer antiferromagnetic (AFM) order and weak in-plane FM coupling. We showed that the proximity effect from bulk semiconducting substrates induces electronic doping and significantly increases the FM nearest-neighbor exchange for bilayer CrI3, leading to the AFM-to-FM transition for the interlayer spin configuration as well as enhanced intralayer FM coupling. By first-principles calculations and Monte Carlo simulations, bulk and 2D semiconductors providing different interaction strengths from strong covalent bonding to weak van der Waals (vdW) interaction with CrI3 are compared to thoroughly address the substrate effect on magnetic behavior and Curie temperature of bilayer CrI3. These theoretical results offer a facile route for direct synthesis of 2D ferromagnets on proper semiconducting substrates to achieve high Curie temperature for device implementation.

中文翻译:

块状半导体衬底上双层CrI3中的高居里温度铁磁性

居里温度高的二维(2D)铁磁(FM)半导体一直被用于电子和自旋电子应用。在这里,我们提供了在双层中实现鲁棒FM状态的一般策略一世3单斜堆叠的本质是层间反铁磁(AFM)阶和平面内FM耦合弱。我们表明,大块半导体衬底的邻近效应会引起电子掺杂,并显着增加双分子层的FM最近邻居交换一世3,导致层间自旋配置从AFM到FM过渡以及增强的层内FM耦合。通过第一性原理计算和蒙特卡洛模拟,块状和2D半导体提供了不同的相互作用强度,从强共价键结合到弱范德华(vdW)相互作用,一世3 比较以彻底解决衬底对双层的磁性和居里温度的影响 一世3。这些理论结果为在合适的半导体衬底上直接合成2D铁磁体以实现器件实现高居里温度提供了一条简便的途径。
更新日期:2020-09-15
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