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We introduce new type of ferromagnets, CaN and SrN, which were designed using first-principles calculations. These are half-metallic ferromagnets and they have magnetic moments of 1 $\mu_{\rm B}$ per chemical formula unit. Out of the…

Materials Science · Physics 2009-09-29 Masaaki Geshi , Koichi Kusakabe , Hitose Nagara , Naoshi Suzuki

Material structures containing tetrahedral FeAs bonds, depending on their density and geometrical distribution, can host several competing quantum ground states ranging from superconductivity to ferromagnetism. Here we examine structures of…

We construct a phase diagram of the parent compound Fe1+xTe as a function of interstitial iron x in terms of the electronic, structural, and magnetic properties. For a concentration of x < 10%, Fe1+xTe undergoes a "semimetal" to metal…

Strongly Correlated Electrons · Physics 2015-06-17 E. E. Rodriguez , D. A. Sokolov , C. Stock , M. A. Green , O. Sobolev , J. A. Rodriguez-Rivera , H. Cao , A. Daoud-Aladine

Half-metallic ferromagnetism (FM) in single-crystal Ba{0.39(1)}Rb{0.61(1)}Mn2As2 below its Curie temperature TC = 103(2) K is reported. The magnetization M versus applied magnetic field H isotherm data at 1.8 K show complete polarization of…

Strongly Correlated Electrons · Physics 2015-12-08 Abhishek Pandey , D. C. Johnston

We perform high-field magnetization measurements on the triangular lattice antiferromagnet Fe$_{1/3}$NbS$_2$. We observe a plateau in the magnetization centered at approximately half the saturation magnetization over a wide range of…

We propose to replace Ga in (Ga,Mn)As with Li and Zn as a route to high Curie temperature, carrier mediated ferromagnetism in a dilute moment n-type semiconductor. Superior material characteristics, rendering Li(Zn,Mn)As a realistic…

Materials Science · Physics 2015-06-25 J. Masek , J. Kudrnovsky , F. Maca , B. L. Gallagher , R. P. Campion , D. H. Gregory , T. Jungwirth

The emergence of the field of spintronics brought half-metallic ferromagnets to the center of scientific research. A lot of interest was focused on newly created transition-metal pnictides (such as CrAs) and chalcogenides (such as CrTe) in…

Materials Science · Physics 2009-11-11 Ph. Mavropoulos , I. Galanakis

Combining density-functional theory calculations with many-body Green's-function technique, we reveal that the macroscopic magnetization in half-metallic antiferromagnets does not vanish at finite temperature as for the T=0 limit. This…

Materials Science · Physics 2015-05-14 Ersoy Sasioglu

The origin of the $A$-type antiferromagnetic ordering, characterized by ferromagnetic layers coupling antiferromagnetically, in the prototype semiconductor altermagnet $\alpha$-MnTe has been a topic of ongoing debate. Experimentally,…

We report the theoretical prediction of a new class of spintronic materials, namely bipolar magnetic semiconductor (BMS), which is also supported by our experimental data. BMS acquires a unique band structure with unequal band gaps for spin…

Applied Physics · Physics 2020-11-21 Jadupati Nag , Deepika Rani , Jiban Kangsabanik , P. D. Babu , K. G. Suresh , Aftab Alam

Alloying effects by T=Mn,Co,Ni-substitution on FeS$_2$ have been investigated using density-functional calculations. The ferromagnetic alloys Fe$_{1-x}$T$_x$S$_2$ have been investigated for concentrations…

Materials Science · Physics 2015-12-16 Abdesalem Houari , Peter E. Blöchl

We propose a ferromagnetic Heusler alloy that can switch between a metal and a half-metal. Thiseffect can provide tunable spintronics properties. Using the density functional theory (DFT) withreliable implementations of the electron…

Half-metals have been envisioned as active components in spintronic devices by virtue of their completely spin-polarized electrical currents. Actual materials hosting half-metallic phases, however, remain scarce. Here, we predict that…

The recent emergence of van der Waals (vdW) ferromagnets has opened new opportunities for designing spintronic devices. We theoretically investigate the coherent spin-dependent transport properties of the vdW ferromagnet Fe$_4$GeTe$_2$, by…

Materials Science · Physics 2024-03-18 Anita Halder , Declan Nell , Antik Sihi , Akash Bajaj , Stefano Sanvito , Andrea Droghetti

Six half-metallic ferromagnets X0.75Y0.25C (X=Si, Ge, Sn and Y =Ca and Sr) with zinc-blende structure, resulting from alkaline-earth (Ca, Sr) substitution for X, are predicted based on the density functional theory. The calculated total…

Materials Science · Physics 2012-01-06 Xiao-Ping Wei , Xian-Ru Hu , Hong Deng , Shi-Bin Chu , Jian-Bo Deng

To optimize the processing conditions for the (Cr,Fe)S non-equilibrium phase with a pyrrhotite-type structure, the phase states and magnetic properties of the specimens obtained at various sintering temperatures were investigated. A…

The current status of research on the carrier-mediated ferromagnetism in tetrahedrally coordinated semiconductors is briefly reviewed. The experimental results for III-V semiconductors, where Mn atoms introduce both spins and holes, are…

Materials Science · Physics 2013-11-15 Tomasz Dietl , Hideo Ohno

The influence of a partial substitution with S, Te, Co, Ni and Cu atoms on the electronic structure of the FeSe superconductor has been investigated within the density functional theory. The results of the supercell calculations reveal…

Superconductivity · Physics 2013-08-13 A. Ciechan , M. J. Winiarski , M. Samsel-Czekała

While most calculations on the properties of the ferromagnetic semiconductor GaAs:Mn have focussed on isolated Mn substituting the Ga site (Mn$_{Ga}$), we investigate here whether alternate lattice sites are favored and what the magnetic…

Condensed Matter · Physics 2009-11-10 Priya Mahadevan , Alex Zunger

We use the Kondo lattice model to investigate the possibility of ferromagnetism and half-metallicity in local moment systems. Using the spectral density approach and making use of the fact that the spontaneous magnetization of local moment…

Materials Science · Physics 2015-05-28 L. Haritha , G. Gangadhar Reddy , A. Ramakanth
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