Role of anion doping on electronic structure and magnetism of GdN by first principles calculations
Role of anion doping on electronic structure and magnetism of GdN by first principles calculations
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第一性原理计算阴离子掺杂对 GdN 电子结构和磁性的影响
DOI:
10.1039/c3ra43998d
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发表时间:
2014
期刊:
影响因子:
3.9
通讯作者:
Bai, H. L.
中科院分区:
文献类型:
--
作者:
Guo, Z. B.;Cheng, Y. C.;Chen, G. F.;Bai, H. L.
We have investigated the electronic structure and magnetism of anion doped GdN1−yXy (X = B, C, O, F, P, S and As) systems by first-principles calculations based on density functional theory. GdN1−yXy systems doped by O, C, F, P, and S atoms are more stabl
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