Electronic structure and magnetism of transition-metal mononitride

被引：10

作者：

Shimizu, H

Shirai, M

Suzuki, N

机构：

[1] Department of Material Physics, Faculty of Engineering Science, Osaka University, Toyonaka 560

来源：

PHYSICA B | 1997年 / 237卷

关键词：

transition metal mononitride; band structure calculation; antiferromagnetism; ferromagnetism;

D O I：

10.1016/S0921-4526(97)00223-8

中图分类号：

O469 [凝聚态物理学];

学科分类号：

070205 ;

摘要：

We perform systematically FLAPW band calculations for transition-metal mononitrides MN (M = Sc, Ti, V, Cr, Mn, Fe, Co, Ni, Cu). The equilibrium lattice constants are determined from the total energy calculations and the results are compared with the existing experimental data. We calculate also the hyperfine field at the Fe site in NaCl-type FeN, and effects of the defects of N atoms on the hyperfine field are discussed.

引用

页码：546 / 547

页数：2

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