Ab-initio study of electronic structure of ScAuSn

被引：0
|
作者：
Ugur, S. [1 ]
Ugur, G. [1 ]
Soyalp, F. [1 ]
机构：
[1] Gazi Univ, Fac Arts & Sci, Dept Phys, TR-06500 Ankara, Turkey
来源：
SIX INTERNATIONAL CONFERENCE OF THE BALKAN PHYSICAL UNION | 2007年 / 899卷
关键词：
density functional theory; GGA; band structure;
D O I：
暂无
中图分类号：
O4 [物理学];
学科分类号：
0702 ;
摘要：
The structural and electronic properties of ScAuSn in the space group F(4) over bar 3m have been studied, using density functional theory within the generalized gradient approximation. The lattice constant of this material is found to be 6.50 angstrom, which compares very well with the experimental value of 6.56 angstrom. We have also carried out band structure and density of states calculations for ScAuSn.
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页码：667 / 667
页数：1
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