Origin and Enhancement of Hole-Induced Ferromagnetism in First-Row d0 Semiconductors

被引:409
作者
Peng, Haowei [1 ]
Xiang, H. J. [2 ]
Wei, Su-Huai [2 ]
Li, Shu-Shen [1 ]
Xia, Jian-Bai [1 ]
Li, Jingbo [1 ]
机构
[1] Chinese Acad Sci, Inst Semicond, State Key Lab Superlattices & Microstruct, Beijing 100083, Peoples R China
[2] Natl Renewable Energy Lab, Golden, CO 80401 USA
基金
中国国家自然科学基金;
关键词
COLLECTIVE ELECTRON FERROMAGNETISM; ENERGY; MODEL;
D O I
10.1103/PhysRevLett.102.017201
中图分类号
O4 [物理学];
学科分类号
0702 ;
摘要
The origin of ferromagnetism in d(0) semiconductors is studied using first-principles methods with ZnO as a prototype material. We show that the presence of spontaneous magnetization in nitrides and oxides with sufficient holes is an intrinsic property of these first-row d(0) semiconductors and can be attributed to the localized nature of the 2p states of O and N. We find that acceptor doping, especially doping at the anion site, can enhance the ferromagnetism with much smaller threshold hole concentrations. The quantum confinement effect also reduces the critical hole concentration to induce ferromagnetism in ZnO nanowires. The characteristic nonmonotonic spin couplings in these systems are explained in terms of the band coupling model.
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页数:4
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