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Ferromagnetism and half-metallicity in two-dimensionalMO(M=Ga,In)monolayers induced by hole doping
Physical Review Materials ( IF 3.4 ) Pub Date : 2020-07-06 , DOI: 10.1103/physrevmaterials.4.074001 Ruishen Meng , Michel Houssa , Konstantina Iordanidou , Geoffrey Pourtois , Valeri Afanasiev , André Stesmans
Physical Review Materials ( IF 3.4 ) Pub Date : 2020-07-06 , DOI: 10.1103/physrevmaterials.4.074001 Ruishen Meng , Michel Houssa , Konstantina Iordanidou , Geoffrey Pourtois , Valeri Afanasiev , André Stesmans
Identification of two-dimensional (2D) materials with magnetic properties has received strong research attention in the development of advanced spin-based devices. By means of first-principles calculations, we investigate the stability, electronic properties, and the hole-doping-induced magnetic properties of metal oxide () monolayers. They are intrinsically nonmagnetic stable semiconductors, with high energetic, vibrational, and thermal stability. Hole doping can switch them from nonmagnetic to ferromagnetic and turn them into half-metals over a wide range of hole densities. Monte Carlo simulations predict that the highest Curie temperature of the GaO monolayer can reach ∼125 K. Our results indicate that monolayer could be eligible candidate materials for 2D spintronic devices.
中文翻译:
空穴掺杂在二维MO(M = Ga,In)单层中的铁磁性和半金属性
具有磁性的二维(2D)材料的识别在高级自旋器件的开发中受到了广泛的研究关注。通过第一性原理计算,我们研究了金属氧化物的稳定性,电子性能以及空穴掺杂引起的磁性能()单层。它们本质上是非磁性稳定的半导体,具有高的能量,振动和热稳定性。空穴掺杂可以将它们从非磁性转变为铁磁性,并且可以在很大的空穴密度范围内将它们变成半金属。蒙特卡罗模拟预测,GaO单层的最高居里温度可以达到约125K。我们的结果表明,单层 可能是2D自旋电子设备的合格候选材料。
更新日期:2020-07-06
中文翻译:
空穴掺杂在二维MO(M = Ga,In)单层中的铁磁性和半金属性
具有磁性的二维(2D)材料的识别在高级自旋器件的开发中受到了广泛的研究关注。通过第一性原理计算,我们研究了金属氧化物的稳定性,电子性能以及空穴掺杂引起的磁性能()单层。它们本质上是非磁性稳定的半导体,具有高的能量,振动和热稳定性。空穴掺杂可以将它们从非磁性转变为铁磁性,并且可以在很大的空穴密度范围内将它们变成半金属。蒙特卡罗模拟预测,GaO单层的最高居里温度可以达到约125K。我们的结果表明,单层 可能是2D自旋电子设备的合格候选材料。