LOCAL SPIN MOMENTS OF TRANSITION-METAL IMPURITIES IN MONOVALENT SIMPLE-METAL HOSTS

被引:43
作者
PAPANIKOLAOU, N [1 ]
STEFANOU, N [1 ]
ZELLER, R [1 ]
DEDERICHS, PH [1 ]
机构
[1] FORSCHUNGSZENTRUM JULICH, INST FESTKORPERFORSCH, W-5170 JULICH 1, GERMANY
来源
PHYSICAL REVIEW B | 1992年 / 46卷 / 17期
关键词
D O I
10.1103/PhysRevB.46.10858
中图分类号
T [工业技术];
学科分类号
08 ;
摘要
The local magnetic properties of 3d and 4d substitutional impurities in noble and alkali-metal hosts are investigated by means of self-consistent local-spin-density-functional calculations using the jellium model as well as the first-principles Korringa-Kohn-Rostoker-Green's-function method. The results for the impurity moment from both calculations are in good agreement and compare well with the available experimental data. Our calculations give a consistent picture for the formation of local impurity spin moments in free-electron-like hosts.
引用
收藏
页码:10858 / 10865
页数:8
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