Half-metallic ferromagnetism induced by dynamic electron correlations in VAs

被引:40
作者
Chioncel, L. [1 ]
Mavropoulos, Ph.
Lezaic, M.
Bluegel, S.
Arrigoni, E.
Katsnelson, M. I.
Lichtenstein, A. I.
机构
[1] Graz Univ Technol, Inst Theoret Phys, A-8010 Graz, Austria
[2] Univ Oradea, Fac Sci, RO-410087 Oradea, Romania
[3] Forschungszentrum Julich, Inst Festkorperforsch, D-52425 Julich, Germany
[4] Univ Nijmegen, NL-6525 ED Nijmegen, Netherlands
[5] Univ Hamburg, Inst Theoret Phys, DE-20355 Hamburg, Germany
关键词
D O I
10.1103/PhysRevLett.96.197203
中图分类号
O4 [物理学];
学科分类号
0702 ;
摘要
The electronic structure of the VAs compound in the zinc-blende structure is investigated using a combined density-functional and dynamical mean-field theory approach. Contrary to predictions of a ferromagnetic semiconducting ground state obtained by density-functional calculations, dynamical correlations induce a closing of the gap and produce a half-metallic ferromagnetic state. These results emphasize the importance of dynamic correlations in materials suitable for spintronics.
引用
收藏
页数:4
相关论文
共 44 条
[1]   Material design of half-metallic zinc-blende CrAs and the synthesis by molecular-beam epitaxy [J].
Akinaga, H ;
Manago, T ;
Shirai, M .
JAPANESE JOURNAL OF APPLIED PHYSICS PART 2-LETTERS & EXPRESS LETTERS, 2000, 39 (11B) :L1118-L1120
[2]   Muffin-tin orbitals of arbitrary order [J].
Andersen, OK ;
Saha-Dasgupta, T .
PHYSICAL REVIEW B, 2000, 62 (24) :16219-16222
[3]   First-principles calculations of the electronic structure and spectra of strongly correlated systems: dynamical mean-field theory [J].
Anisimov, VI ;
Poteryaev, AI ;
Korotin, MA ;
Anokhin, AO ;
Kotliar, G .
JOURNAL OF PHYSICS-CONDENSED MATTER, 1997, 9 (35) :7359-7367
[4]   First-order transition between a small gap semiconductor and a ferromagnetic metal in the isoelectronic alloy FeSi1-xGex -: art. no. 257203 [J].
Anisimov, VI ;
Hlubina, R ;
Korotin, MA ;
Mazurenko, VV ;
Rice, TM ;
Shorikov, AO ;
Sigrist, M .
PHYSICAL REVIEW LETTERS, 2002, 89 (25) :1-257203
[5]  
ARYASETIAWAN F, CONDMAT0603138
[6]   Ab initio electronic structure calculations of correlated systems:: An EMTO-DMFT approach -: art. no. 235106 [J].
Chioncel, L ;
Vitos, L ;
Abrikosov, IA ;
Kollár, J ;
Katsnelson, MI ;
Lichtenstein, AI .
PHYSICAL REVIEW B, 2003, 67 (23)
[7]   Tunable spin transport in CrAs: Role of correlation effects [J].
Chioncel, L ;
Katsnelson, MI ;
de Wijs, GA ;
de Groot, RA ;
Lichtenstein, AI .
PHYSICAL REVIEW B, 2005, 71 (08)
[8]   Nonquasiparticle states in the half-metallic ferromagnet NiMnSb [J].
Chioncel, L ;
Katsnelson, MI ;
de Groot, RA ;
Lichtenstein, AI .
PHYSICAL REVIEW B, 2003, 68 (14)
[9]   NEW CLASS OF MATERIALS - HALF-METALLIC FERROMAGNETS [J].
DEGROOT, RA ;
MUELLER, FM ;
VANENGEN, PG ;
BUSCHOW, KHJ .
PHYSICAL REVIEW LETTERS, 1983, 50 (25) :2024-2027
[10]   ELECTRON-MAGNON INTERACTIONS IN ITINERANT FERROMAGNETISM .2. STRONG FERROMAGNETISM [J].
EDWARDS, DM ;
HERTZ, JA .
JOURNAL OF PHYSICS F-METAL PHYSICS, 1973, 3 (12) :2191-2205