Nonmagnetic impurities induced magnetism in SnO2

Nonmagnetic impurities induced magnetism in SnO2
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SnO2 中的非磁性杂质诱发磁性

DOI:
10.1016/j.jmmm.2009.06.016
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发表时间:
2009-10
影响因子:
2.7
通讯作者:
Wu, Ping
Wu, Ping
中科院分区:
材料科学3区
文献类型:
--
作者:
Liu, Lijuan;Zhou, Wei;Wu, Ping

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A density functional study is performed to investigate the magnetism induced by the nonmagnetic impurity substitution for the cation in SnO2. The calculated results show that the K impurity substitution leads to a robust magnetism in SnO2, and the induced magnetic moments are mainly attributed to the first shell of oxygen atoms surrounding the impurity atom. Meanwhile, no magnetism is observed in SnO2doped with Ca which implies a decreasing tendency of induced magnetic moments for Sn substituted by vacancy, K, and Ca. It is also demonstrated that the magnetic coupling constant oscillates as a function of K–K separation distance, and the Curie temperature above room temperature can be obtained in K-doped SnO2.
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