Electronic Structure and Magnetic Properties of ( Co1-x TMx) 3V2O8, ( TM= Mn, Mg and Zn) Compounds

被引:3
作者
Jezierski, A. [1 ]
Kaczkowski, J. [1 ]
Szymczak, R. [2 ]
Szymczak, H. [2 ]
机构
[1] Polish Acad Sci, Inst Mol Phys, PL-60179 Poznan, Poland
[2] Polish Acad Sci, Inst Phys, PL-02668 Warsaw, Poland
关键词
Multiferroics; Co3V2O8; electronic structure; ab-initio methods; magnetic properties; FPLO; CRYSTAL-GROWTH; ORTHOVANADATE;
D O I
10.1080/00150193.2014.889976
中图分类号
T [工业技术];
学科分类号
08 ;
摘要
The electronic structure and magnetic properties of the kagome staircase compound Co(3)V(2)O(8)doped by 3-d elements (Mn, Mg and Zn) have been investigated using ab-initio FPLO method. We found that in the case of Mg and Zn the electronic densities of states near the Fermi energy is not significantly modified, however substitution the cobalt by manganese atom changed the band structure near the Fermi energy.
引用
收藏
页码:76 / 84
页数:9
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