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The discovery of ferromagnetism in Mn doped GaAs [1] has ignited interest in the development of semiconductor technologies based on electron spin and has led to several proof-of-concept spintronic devices [2-4]. A major hurdle for realistic…

Materials Science · Physics 2009-11-11 Dale Kitchen , Anthony Richardella , Jian-Ming Tang , Michael E. Flatte , Ali Yazdani

We present a theory of interstitial Mn in Mn-doped ferromagnetic semiconductors. Using density-functional theory, we show that under the non-equilibrium conditions of growth, interstitial Mn is easily formed near the surface by a simple…

Materials Science · Physics 2009-11-07 Steven C. Erwin , A. G. Petukhov

We present a spin density functional theory (DFT) study for semiconducting ScN and Mn-substituted ScN. Their structural and magnetic properties have been investigated using the all electrons augmented spherical wave method (ASW) with a…

Materials Science · Physics 2009-09-10 Abdesalem Houari , Samir. F. Matar , Mohamed A. Belkhir

After more than a decade of intensive research in the field of diluted magnetic semiconductors (DMS), the nature and origin of ferromagnetism, especially in III-V compounds is still controversial. Many questions and open issues are under…

Disordered Systems and Neural Networks · Physics 2015-11-09 Georges Bouzerar , Richard Bouzerar

Using a joint approach of density functional theory and model calculations, we demonstrate that a prototypical charge ordered half-doped manganite, La$_{1/2}$Ca$_{1/2}$MnO$_3$ is multiferroic. The combination of a peculiar charge-orbital…

Materials Science · Physics 2010-07-15 Gianluca Giovannetti , Sanjeev Kumar , Jeroen van den Brink , Silvia Picozzi

Cross sectional scanning tunneling microscopy (XSTM) and density functional theory have been used to characterize the structure of GaSb digitally doped with Mn. The Mn dopants are found in both isolated substitutional form as well as in…

Materials Science · Physics 2009-11-10 G. I. Boishin , J. M. Sullivan , L. J. Whitman

Magnetoresistance measurements on the magnetic semiconductor (In,Mn)Sb suggest that magnetic scattering in this material is dominated by isolated Mn$^{2+}$ ions located outside the ferromagnetically-ordered regions when the system is below…

Other Condensed Matter · Physics 2009-11-11 M. Csontos , T. Wojtowicz , X. Liu , M. Dobrowolska B. Jankó , J. K. Furdyna , G. Mihály

The rapidly developing field of ferromagnetism in diluted magnetic semiconductors, where a semiconductor host is magnetically doped by transition metal impurities to produce a ferromagnetic semiconductor (e.g. Ga_{1-x}Mn_xAs with x ~ 1-10…

Materials Science · Physics 2009-11-10 S. Das Sarma , E. H. Hwang , A. Kaminski

A microscopic Hamiltonian for interacting manganese impurities in diluted magnetic semiconductors (DMS) is derived. It is shown that in p -type III-V DMS the indirect exchange between Mn impurities has similarities with the Zener mechanism…

Condensed Matter · Physics 2009-11-07 V. A. Ivanov , P. M. Krstajic , F. M. Peeters , V. Fleurov , K. Kikoin

Structural and electronic properties of pristine and transition metal doped ZnS monolayer are investigated within the framework of density functional theory. The pristine ZnS monolayer is showing direct band gap of about 2.8 eV. The…

Materials Science · Physics 2017-11-16 Rajneesh Chaurasiya , Ambesh Dixit

We calculate magnetization in magnetically doped semiconductors assuming a local exchange model of carrier-mediated ferromagnetic mechanism and using a number of complementary theoretical approaches. In general, we find that the results of…

Materials Science · Physics 2009-11-07 S. Das Sarma , E. H. Hwang , A. Kaminski

We report on structural, susceptibility, conductivity, and heat-capacity studies of FeSe0.5Te0.5 single crystals with 2% substitution of Mn for Fe. Mn-doped samples show a higher onset temperature, a narrower width of the superconducting…

Superconductivity · Physics 2011-03-25 A. Günther , J. Deisenhofer , Ch. Kant , H. -A. Krug von Nidda , V. Tsurkan , A. Loidl

The behavior of spin diffusion in doped semiconductors is shown to be qualitatively different than in undoped (intrinsic) ones. Whereas a spin packet in an intrinsic semiconductor must be a multiple-band disturbance, involving inhomogeneous…

Materials Science · Physics 2009-10-31 Michael E. Flatte , Jeff M. Byers

The magnetic order associated with the degree of freedom of spin in two-dimensional (2D) materials is subjected to intense investigation because of its potential application in 2D spintronics and valley-related magnetic phenomena. We report…

Materials Science · Physics 2019-06-13 M. T. Dau , C. Vergnaud , M. Gay , C. J. Alvarez , A. Marty , C. Beigné , D. Jalabert , J. -F. Jacquot , O. Renault , H. Okuno , M. Jamet

We employ the dynamical mean field approximation to perform a systematic study of magnetism in Ga_{1-x}Mn_xAs. Our model incorporates the effects of the strong spin-orbit coupling on the J=3/2 GaAs valence bands and of the exchange…

Strongly Correlated Electrons · Physics 2007-05-23 K. Aryanpour , J. Moreno , M. Jarrell , R. S. Fishman

A density functional theory of ferromagnetism in heterostructures of compound semiconductors doped with magnetic impurities is presented. The variable functions in the density functional theory are the charge and spin densities of the…

Condensed Matter · Physics 2009-11-07 J. Fernandez-Rossier , L. J. Sham

We examine the possibility of probing superconductivity effects in metal nanoclusters via diamond magnetometry. Metal nanoclusters have been proposed as constitutive elements of high T$_c$ superconducting nanostructured materials.…

Superconductivity · Physics 2011-03-01 Louis-S. Bouchard , Victor M. Acosta , Erik Bauch , Dmitry Budker

This paper, based on a presentation at the Spintronics 2001 conference, provides a review of our studies on II-VI and III-V Mn-doped Diluted Magnetic Semiconductors. We use simple models appropriate for the low carrier density (insulating)…

Materials Science · Physics 2007-05-23 R. N. Bhatt , Mona Berciu , Malcolm P. Kennett , Xin Wan

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

Using first-principles density functional theory method, we have investigated the distribution and magnetism of doped Mn atoms in the vicinity of the 3 (112) grain boundary in Ge. We find that at low concentration, the substitutional sites…

Materials Science · Physics 2010-05-24 W. Wang , S. L. Zhang , Z. X. Tian , W. Xiao