Electronic structure and the site preference of manganese in Fe3Si alloy

被引：22

作者：

Go, A.

Pugaczowa-Michalska, M.

Dobrzynski, L.

机构：

[1] Univ Bialystok, Inst Expt Phys, PL-15424 Bialystok, Poland

[2] Polish Acad Sci, Inst Mol Phys, PL-60179 Poznan, Poland

[3] Soltan Inst Nucl Studies, PL-05400 Otwock, Poland

来源：

EUROPEAN PHYSICAL JOURNAL B | 2007年 / 59卷 / 01期

关键词：

D O I：

10.1140/epjb/e2007-00263-7

中图分类号：

O469 [凝聚态物理学];

学科分类号：

070205 ;

摘要：

Ab initio calculations of the magnetic properties and site preference of Mn in Fe3-xMnxSi were carried out using density functional theory and employing the TB-LMTO-ASA method. Qualitative agreement with the experimental results is obtained for site preference as well as for total and local magnetic moments. It is postulated that short-range order would explain observed discrepancies between theoretical and experimental results.

引用

页码：1 / 8

页数：8

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