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Related papers: Electronic structure of half-metallic magnets

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We report intrinsic ferromagnetism in monolayer electrides or electrenes, in which excess electrons act as anions. Our first-principles calculations demonstrate that magnetism in such electron-rich two-dimensional (2D) materials originates…

Computational Physics · Physics 2020-11-25 Jun Zhou , Yuan Ping Feng , Lei Shen

We search for new fully compensated half metals, in which only one electronic spin channel is conducting and there exists no net magnetic moment. We focus on half Heusler alloys and we examine the physical consequence of different crystal…

Materials Science · Physics 2011-08-19 Michael Shaughnessy , C. Y. Fong , Lin H. Yang , Claudia Felser

The spin-dependent band structure of CoS$_2$ which is a candidate for a half-metallic ferromagnet was investigated by both spin- and angle-resolved photoemission spectroscopy and theoretical calculations, in order to reappraise the…

This study provides a first-principles insight into half-Heusler CrMnSb to understand its deviation from the conventional Slater-Pauling semiconducting behavior. CrMnSb, having a valence electron count of 18, has been proposed to exhibit…

We report the electronic structure and related properties of the superconductor Ta2PdSe5 as determined from density functional calculations. The Fermi surface has two disconnected sheets, both derived from bands of primarily chalcogenide p…

Superconductivity · Physics 2015-04-28 David J. Singh

The magnetic structure, magnetoresistance, and Hall effect of non-centrosymmetric magnetic semimetal NdAlGe are investigated revealing an unusual magnetic state and anomalous transport properties that are associated with the electronic…

Heusler alloys are widely studied due to their interesting structural and magnetic properties, like magnetic memory shape ability, coupled magneto-structural phase transitions and half-metallicity; ruled, for many cases, by the valence…

Half-metallic Heusler alloys are among the most promising materials for future applications in spintronic devices. Although most Heusler alloys are ferromagnets, ferrimagnetic or antiferromagnetic (also called fully-compensated…

Materials Science · Physics 2015-05-13 I. Galanakis , K. Ozdogan , E. Sasioglu , B. Aktas

The Fe_{x}Co_{1-x}S_{2} system is predicted, on the basis of density functional calculations, to be a half metal for a large range of concentrations. Unlike most known half metals, the half metallicity in this system should be very stable…

Materials Science · Physics 2007-05-23 I. I. Mazin

Electronic structures of MC where M is the alkali and alkaline earth metals with the rocksalt structure are calculated by full potential density functional codes. We find that the spin magnetic moment in the compounds is mainly contributed…

Materials Science · Physics 2012-11-02 Wenxu Zhang , Zhida Song , Bin Peng , Wanli Zhang

The search for high-performance spintronic materials motivates the exploration of Heusler alloys with unconventional electronic properties. Using density functional theory with Hubbard correction (DFT+$U$, $U = 4$ eV), we investigate…

Materials Science · Physics 2025-09-24 N. Bouteldja , N. Hacini , I. Ouadha , H. Rached

We grew needle-shaped single crystals of GdAgGe, which crystallizes in a noncentrosymmetric hexagonal crystal structure with space group P$\overline{6}$2$m$ (189). The magnetic susceptibility data for $H \perp c$ reveal two pronounced…

Strongly Correlated Electrons · Physics 2024-01-30 D. Ram , J. Singh , M. K. Hooda , O. Pavlosiuk , V. Kanchana , Z. Hossain , D. Kaczorowski

Electron-electron correlations affect the band gap of half-metallic ferromagnets by introducing non-quasiparticle states just above the Fermi level. In contrast to the spin-orbit coupling, a large asymmetric non-quasiparticle spectral…

Strongly Correlated Electrons · Physics 2014-04-15 L. Chioncel , E. Arrigoni , M. I. Katsnelson , A. I. Lichtenstein

Recent thermodynamic measurements on two-dimensional (2D) electron systems have found diverging behavior in the magnetic susceptibility and appearance of ferromagnetism with decreasing electron density. The critical densities for these…

Strongly Correlated Electrons · Physics 2007-05-23 S. M. Fazeli , K. Esfarjani , B. Tanatar

We report the topological electronic structure, magnetic, and magnetotransport properties of a noncentrosymmetric compound GdAlSi. Magnetic susceptibility shows an antiferromagnetic transition at $T_\mathrm{N}$ = 32 K. In-plane isothermal…

The electrical resistivity, magnetization, and Hall effect in Co$_2$FeZ (Z = Al, Si, Ga, Ge, Sn, Sb) ferromagnetic Heusler alloys are studied. A number of correlations between the electronic and magnetic characteristics of the studied…

Materials Science · Physics 2025-02-19 Yu. A. Perevozchikova , V. Yu. Irkhin , A. A. Semiannikova , V. V. Marchenkov

A ternary ferrimagnetic half-metal, constructed through substituting 25% Fe for Mn in zincblende semiconductor MnTe, is predicted in terms of accurate first-principles calculations. It has a large half-metallic (HM) gap of 0.54eV and its…

Materials Science · Physics 2009-04-10 Li-Fang Zhu , Bang-Gui Liu

Taking into considerations the wide compositional stretch of Heusler alloys, the first principles density functional theory based calculations are excellently suitable for estimating the multifaceted properties of alkali metal based LiVSb…

Materials Science · Physics 2024-07-03 Diwaker , Shyam L. Gupta , Anupam , Sumit Kumar , Aadil Fayaz , Ashwani Kumar

It is shown by rigorous ab initio calculations that half-Heusler alloys of transition metals and $d^0$ metals, defined by the valence electronic configuration $ns^{1,2},(n-1)d^0$, can produce all kinds of half-metallic behavior including…

Materials Science · Physics 2017-02-28 S. Davatolhagh , A. Dehghan

The interplay of magnetic and semiconducting properties has been in the focus since more than a half of the century. In this introductory article we briefly review the key properties and functionalities of various magnetic semiconductor…

Materials Science · Physics 2019-09-09 Tomasz Dietl , Alberta Bonanni , Hideo Ohno
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