The magnetic phase transition in Cu-doped ZnO: From bulk to nanocluster

来源 :中国物理学会2011年秋季学术会议 | 被引量 : 0次 | 上传用户:gaoxiaoyu123
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We have investigated the magnetic properties of Cu-doped ZnO both in bulk and nanocluster by the first-principles calculations.It is found that the magnetic phase has a transition from FM phase to AFM phase as the the size for the doping system decreases from bulk to nanocluster.The Cu ions have a tendency to assemble.In Cu-doped bulk ZnO,the ferromagnetism arises from the strong hybridization between Cu 3d and O 2p orbitals.
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