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We report here our study on SiC doped with transition metals using first principle density functional theory calculations. We have considered cubic SiC with 3d transition metals as substitutional impurities for Si and C site separately.…

Materials Science · Physics 2011-11-28 Padmaja Patnaik , Gautam Mukhopadhyay , Prabhakar P. Singh

We present a theoretical study of the exchange interaction in a system of spatially disordered magnetic moments. A typical example of such a system is an impurity semiconductor, whose magnetic properties are associated with the exchange…

Strongly Correlated Electrons · Physics 2025-06-25 N. A. Bogoslovskiy , P. V. Petrov , N. S. Averkiev

Despite the various magnetic orders mediated by superexchange mechanism, the existence of a long range antiferromagnetic (AFM) coupling is unknown. Based on DFT calculations, we discovered an intrinsic long range AFM coupling in V doped…

Materials Science · Physics 2020-04-22 Weiyi Gong , Ching-Him Leung , Chuen-Keung Sin , Jingzhao Zhang , Xiaodong Zhang , Bin Xi , Junyi Zhu

We present a study of the dielectric function of metallic (III,Mn)V diluted magnetic semiconductors in the infrared regime. Our theoretical approach is based on the kinetic exchange model for carrier induced (III,Mn)V ferromagnetism. The…

Materials Science · Physics 2009-11-10 R. Aguado , M. P. López-Sancho , Jairo Sinova , L. brey

We have analyzed the electronic structure of half-metallic magnets based on first principles electronic structure calculations of a series of semi-Heusler alloys. The characteristic feature of the electronic structure of semi-Heusler…

Materials Science · Physics 2007-05-23 B. R. K. Nanda , I. Dasgupta

Discovering new antiferromagnetic compounds is at the forefront of developing future spintronic devices without fringing magnetic fields. The antiferromagnetic gapless semiconducting D03 phase of V3Al was successfully synthesized via…

Materials Science · Physics 2015-06-24 M. E. Jamer , B. A. Assaf , G. E. Sterbinsky , D. Arena , L. H. Lewis , A. A. Saúl , G. Radtke , D. Heiman

Half-metallic ferromagnets can produce fully spin-polarized conduction electrons and can be applied to fabricate spintronic devices. Thus, in this study, the electronic structure, magnetic properties, and optical properties of GaSb, which…

Materials Science · Physics 2020-01-07 Chuang Wang , Wenhui Wan , Yanfeng Ge , Yong-Hong Zhao , Kaicheng Zhang , Yong Liu

Antiferromagnetic spintronics is an on-going growing field of research. Employing both standard density functional theory and the $GW$ approximation within the framework of the FLAPW method, we study the electronic and magnetic properties…

Materials Science · Physics 2017-02-23 M. Tas , E. Sasioglu , C. Friedrich , S. Blugel , I. Galanakis

Ferromagnetism is predicted in undoped diluted magnetic semiconductors illuminated by intense sub-bandgap laser radiation . The mechanism for photo-induced ferromagnetism is coherence between conduction and valence bands induced by the…

Mesoscale and Nanoscale Physics · Physics 2009-11-10 J. Fernández-Rossier , C. Piermarocchi , P. Chen , A. H. MacDonald , L. J. Sham

Two-dimensional (2D) materials with robust magnetism have drawn immense attention for their promising applications in spintronics. Recently, intrinsic ferromagnetic vanadium triiodide (VI3) has been synthesized experimentally. To enhance…

Materials Science · Physics 2021-09-28 Charles Sun , Xuan Luo

Altermagnets and fully-compensated ferrimagnets are two canonical classes of zero-net-moment magnets. An altermagnetic (AM) half-metal cannot exist due to its AM spin splitting, while a fully-compensated ferrimagnetic (FC-FIM) metal seems…

Materials Science · Physics 2025-12-08 San-Dong Guo , Qiqi Luo , Shi-Hao Zhang , Peng Jiang

In a diluted magnetic semiconductor system, the exchange interaction between magnetic impurities has two independent components: a direct antiferromagnetic interaction and a ferromagnetic interaction mediated by charge carriers. Depending…

Disordered Systems and Neural Networks · Physics 2009-11-10 A. Kaminski , Victor Galitski , S. Das Sarma

Otherwise antiferromagnetic chromium is shown to couple ferromagnetically when doped into GaN irrespective of whether the host is a crystal or a cluster. The results on the doped clusters and crystals are obtained from density functional…

Materials Science · Physics 2007-05-23 G. P. Das , B. K. Rao , P. Jena

A review of theoretical and experimental studies of the electronic structure, electronic and magnetic properties of various systems of Heusler alloys in the states of a half-metallic ferromagnet, a spin gapless semiconductor, and a…

Materials Science · Physics 2021-11-30 V. V. Marchenkov , V. Yu. Irkhin

We demonstrate in a simple model the surprising result that turning on an on-site Coulomb interaction U in a doped band insulator leads to the formation of a half-metallic state. In the undoped system, we show that increasing U leads to a…

Strongly Correlated Electrons · Physics 2015-06-16 Arti Garg , H. R. Krishnamurthy , Mohit Randeria

We have investigated electronic structures of a room temperature diluted magnetic semiconductor : Co-doped anatase $\rm TiO_{2}$. We have obtained the half-metallic ground state in the local-spin-density approximation(LSDA) but the…

Materials Science · Physics 2009-11-07 Min Sik Park , S. K. Kwon , B. I. Min

Electronic structure calculation were used to predict a new material for spintronic applications. Co2Mn0.5Fe0.5Si is one example which is stable against on-site correlation and disorder effects due to the position of the Fermi energy in the…

Materials Science · Physics 2013-08-08 Benjamin Balke , Hem C. Kandpal , Gerhard H. Fecher , Claudia Felser

In this research paper, we investigated the structural, electronic, and magnetic features of titanium atom substituting calciumatom in rock salt structure of CaS to explore the new dilute magnetic semiconductor compounds. The calculations…

Materials Science · Physics 2022-02-16 Meryem Ziati , Hamid Ez-Zahraouy

We report on a first principles study of anti-ferromagnetic resonance (AFMR) phenomena in metallic systems [MnX (X=Ir,Pt,Pd,Rh) and FeRh] under an external electric field. We demonstrate that the AFMR linewidth can be separated into a…

Mesoscale and Nanoscale Physics · Physics 2019-01-02 Farzad Mahfouzi , Nicholas Kioussis

We examine the feasibility of a simple description of Mn ions in III-V diluted magnetic semiconductors (DMSs) in terms of two species (components), motivated by the expectation that the Mn-hole exchange couplings are widely distributed,…

Disordered Systems and Neural Networks · Physics 2009-11-07 Malcolm P. Kennett , Mona Berciu , R. N. Bhatt