The electronic structure and spin polarization of Co2Mn0.75(Gd, Eu)0.25Z (Z = Si, Ge, Ga, Al) quaternary Heusler alloys

被引:41
作者
Berri, Saadi [1 ]
机构
[1] Univ Setif 1, Lab Dev New Mat & Their Characterizat, Setif, Algeria
关键词
Quaternary Heusler alloys; Half-metallic; Ab initio calculations; HALF-METALLIC FERROMAGNET; MAGNETIC-PROPERTIES; TRANSITION-METAL; CO;
D O I
10.1016/j.jmmm.2015.10.101
中图分类号
T [工业技术];
学科分类号
08 ;
摘要
A first-principles approach is used to study the electronic and magnetic properties of Co2Mn0.75(Gd, Eu)(0.25)Z(Z=Si, Ge, Ga, Al) quaternary Heusler alloys. The investigation was done using the (FP-LAPW) method where the exchange-correlation potential was calculated with the frame of GGA-WC. At ambient conditions our calculated results of band structures reveal that for Co2Mn0.75(Gd, Eu)(0.25)Z(Z=Si, Ge) has a half-metallic (HM) band structure profile showing 100% spin polarization at the Fermi level. In contrast, Co2Mn0.75(Gd, Eu)(0.25)Z(Z=Ga, Al) alloys are found to be metallic. Finally, the half metallic compounds found in some structures of this series might be useful in spintronic devices. (C) 2015 Elsevier B.V. All rights reserved.
引用
收藏
页码:667 / 672
页数:6
相关论文
共 40 条
[1]   Structural properties of magnetic Heusler alloys [J].
Ayuela, A ;
Enkovaara, J ;
Ullakko, K ;
Nieminen, RM .
JOURNAL OF PHYSICS-CONDENSED MATTER, 1999, 11 (08) :2017-2026
[2]   Properties of the quaternary half-metal-type Heusler alloy Co2Mn1-xFexSi [J].
Balke, Benjamin ;
Fecher, Gerhard H. ;
Kandpal, Hem C. ;
Felser, Claudia ;
Kobayashi, Keisuke ;
Ikenaga, Eiji ;
Kim, Jung-Jin ;
Ueda, Shigenori .
PHYSICAL REVIEW B, 2006, 74 (10)
[3]   Rational design of new materials for spintronics:: Co2FeZ (Z = Al, Ga, Si, Ge) [J].
Balke, Benjamin ;
Wurmehl, Sabine ;
Fecher, Gerhard H. ;
Felser, Claudia ;
Kuebler, Juergen .
SCIENCE AND TECHNOLOGY OF ADVANCED MATERIALS, 2008, 9 (01)
[4]   Robust half-metallic ferromagnet of quaternary Heusler compounds ZrCoTiZ(Z = Si, Ge, Ga and Al) [J].
Berri, Saadi ;
Ibrir, Miloud ;
Maouche, Djamel ;
Attallah, Mourad .
COMPUTATIONAL CONDENSED MATTER, 2014, 1 :26-31
[5]   First-principles study on half-metallic properties of the Sr2GdReO6 double perovskite [J].
Berri, Saadi .
JOURNAL OF MAGNETISM AND MAGNETIC MATERIALS, 2015, 385 :124-128
[6]   First principles study of structural, electronic and magnetic properties of ZrFeTiAl, ZrFeTiSi, ZrFeTiGe and ZrNiTiAl [J].
Berri, Saadi ;
Ibrir, Miloud ;
Maouche, Djamel ;
Attallah, Mourad .
JOURNAL OF MAGNETISM AND MAGNETIC MATERIALS, 2014, 371 :106-111
[7]   A first-principle study of half-metallic ferrimagnetism in the CoFeTiSb quaternary Heusler compound [J].
Berri, Saadi ;
Maouche, D. ;
Ibrir, M. ;
Zerarga, F. .
JOURNAL OF MAGNETISM AND MAGNETIC MATERIALS, 2014, 354 :65-69
[8]   STRUCTURAL AND MAGNETIC-PROPERTIES OF THE TERNARY RARE-EARTH (RE) COMPOUND SERIES LAINAU2, TOINAU2, LUINAU2, YINAU2 [J].
BESNUS, MJ ;
KAPPLER, JP ;
RAVET, MF ;
MEYER, A ;
LAHIOUEL, R ;
PIERRE, J ;
SIAUD, E ;
NIEVA, G ;
SERENI, J .
JOURNAL OF THE LESS-COMMON METALS, 1986, 120 (01) :101-112
[9]  
Blaha P., 2001, WIEN2k: An Augmented Plane Wave Plus Local Orbitals Program for Calculating Crystal Properties
[10]  
Blundell S., 2001, MAGNETISM CONDENSED