Investigations of Structural, Electronic, and Half-metallic Ferromagnetic Properties in (Al, Ga, In)1-x M x N (M = Fe, Mn) Diluted Magnetic Semiconductors

被引:45
作者
Doumi, B. [1 ]
Tadjer, A. [1 ]
Dahmane, F. [1 ]
Mesri, D. [1 ]
Aourag, H. [2 ]
机构
[1] Djillali Liabes Univ Sidi Bel Abbes, Dept Phys, Modelling & Simulat Mat Sci Lab, Sidi Bel Abbes 22000, Algeria
[2] Univ Abou Bekr Belkaid Tlemcen, URMER, LEPM, Tilimsen 13000, Algeria
关键词
Spintronics; Half-metals; Double-exchange mechanism; (Fe; Mn) doped III-V nitrides; MATERIAL DESIGN; SPINTRONICS; 1ST-PRINCIPLES; PERSPECTIVE; SPIN; ALN;
D O I
10.1007/s10948-012-1808-6
中图分类号
O59 [应用物理学];
学科分类号
摘要
We investigate the structural, electronic, and magnetic properties of (M = Fe, Mn)-based zinc blende diluted magnetic semiconductors (DMS) (Al, Ga, In)(1-x) M (x) N for (x=0.0625,0.125,0.25), using first-principles calculations with the full-potential linearized augmented plane waves (FP-LAPW) method within the density functional theory and local spin-density approximation. The analysis of electronic structures and magnetic properties show that (Al, Ga, In)(1-x) Fe (x) N at (x=0.0625,0.125,0.25) are magnetic insulators, and In1-x Mn (x) N at (x=0.0625,0.125) are metallic in nature. On the other hand the (Al, Ga)(1-x) Mn (x) N at (x=0.0625,0.125,0.25) and In0.75Mn0.25N are half-metallic ferromagnets with magnetic spin polarization of 100 %, where the ferromagnetic ground states result from a double-exchange mechanism, and these compounds are predicted to be good candidates for spintronic applications.
引用
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页码:515 / 525
页数:11
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