Calculations of the band structure and Curie temperature for Y2Fe17 and Y2Fe17N3
文献类型:期刊论文
作者 | Zhou, YM ; Lai, WY |
刊名 | JOURNAL OF PHYSICS-CONDENSED MATTER
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出版日期 | 1997 |
卷号 | 9期号:13页码:2759 |
关键词 | MAGNETIC-PROPERTIES ELECTRONIC-STRUCTURE TRANSITION-METALS SPIN DENSITY |
ISSN号 | 0953-8984 |
通讯作者 | Zhou, YM: CHINESE ACAD SCI,INST PHYS,BEIJING 100080,PEOPLES R CHINA. |
中文摘要 | The very large enhancement of the Curie temperature in the novel ferromagnetic nitride Y2Fe17N3 results from the obvious change of the electronic structure compared with that of its paternal compound Y2Fe17. Their electronic structures in both spin-polarized and non-spin-polarized states are calculated in the local spin-density functional approximation. From the band structure obtained by us, the Curie temperature of these compounds is calculated by including the effects of both the Stoner excitation and the spin fluctuation on the basis of the theory of Mohn and Wohlfarth without any adjustable parameters. The calculated enhancement of the Curie temperature for the nitride Y2Fe17N3 is in good agreement with the measurement. Our results concerning the enhancement of the Curie temperature Te for this ferromagnet upon nitrogenation suggest that the spin fluctuation is an important factor for this class of compounds, while the Stoner excitation must be involved in the calculation as well. |
收录类别 | SCI |
语种 | 英语 |
公开日期 | 2013-09-17 |
源URL | [http://ir.iphy.ac.cn/handle/311004/34452] ![]() |
专题 | 物理研究所_物理所公开发表论文_物理所公开发表论文_期刊论文 |
推荐引用方式 GB/T 7714 | Zhou, YM,Lai, WY. Calculations of the band structure and Curie temperature for Y2Fe17 and Y2Fe17N3[J]. JOURNAL OF PHYSICS-CONDENSED MATTER,1997,9(13):2759. |
APA | Zhou, YM,&Lai, WY.(1997).Calculations of the band structure and Curie temperature for Y2Fe17 and Y2Fe17N3.JOURNAL OF PHYSICS-CONDENSED MATTER,9(13),2759. |
MLA | Zhou, YM,et al."Calculations of the band structure and Curie temperature for Y2Fe17 and Y2Fe17N3".JOURNAL OF PHYSICS-CONDENSED MATTER 9.13(1997):2759. |
入库方式: OAI收割
来源:物理研究所
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