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We study the dependence of magnetic interactions and Curie temperature in Ni(1+x)MnSb system on the Ni concentration within the framework of the density-functional theory. The calculation of the exchange parameters is based on the…

Materials Science · Physics 2009-11-11 E. Sasioglu , L. M. Sandratskii , P. Bruno

Prediction of the Curie temperature is of significant importance for the design of ferromagnetic materials. Even though the Curie temperature has been estimated using the Heisenberg model, magnetic exchange coupling parameters widely used…

Materials Science · Physics 2020-12-08 Tomonori Tanaka , Yoshihiro Gohda

An efficient method to compute magnetic exchange interactions in systems with strong correlations is introduced. It is based on a magnetic force theorem which evaluates linear response due to rotations of magnetic moments and uses a novel…

Strongly Correlated Electrons · Physics 2007-05-23 Xiangang Wan , Quan Yin , Sergej Y. Savrasov

Magnetic materials are typically described in terms of the Heisenberg model, which provides an accurate account of thermodynamic properties when combined with first principles calculations. This approach is usually based on an energy…

Materials Science · Physics 2020-12-04 Daniele Torelli , Thomas Olsen

Employing first principles electronic structure calculations in conjunction with the frozen-magnon method we calculate exchange interactions, spin-wave dispersion, and spin-wave stiffness constants in inverse-Heusler-based spin gapless…

Materials Science · Physics 2015-05-15 A. Jakobsson , P. Mavropoulos , E. Sasioglu , S. Blugel , M. Lezaic , B. Sanyal , I. Galanakis

We study finite-temperature properties of ultracold four-component mixtures of alkaline-earth-like atoms in optical lattices that can be effectively described by the two-band spin-$1/2$ Hubbard model including the Hund's exchange coupling…

Quantum Gases · Physics 2016-05-31 Agnieszka Cichy , Andrii Sotnikov

The interatomic exchange interactions and Curie temperatures in Ni-based full Heusler alloys Ni2MnX with X=Ga, In, Sn and Sb are studied within the framework of the density-functional theory. The calculation of the exchange parameters is…

Materials Science · Physics 2009-11-10 E. Sasioglu , L. M. Sandratskii , P. Bruno

An ab initio study of magnetic exchange interactions in antiferromagnetic and strongly correlated 3d transition metal monoxides is presented. Their electronic structure is calculated using the local self-interaction correction approach,…

We investigate the contributions of finite-temperature magnetic fluctuations to the thermodynamic properties of bcc Fe as a function of pressure. First, we apply a tight-binding total-energy model parameterized to first-principles…

Materials Science · Physics 2010-07-21 Xianwei Sha* , R. E. Cohen

We have investigated the magnetic properties of Fe, Co, and Ni at finite temperatures on the basis of the first-principles dynamical coherent potential approximation (CPA) in order to clarify the role of the exchange interaction energy…

Strongly Correlated Electrons · Physics 2015-05-27 Y. Kakehashi , M. Atiqur R. Patoary

We investigate the temperature dependence of the finite-field magnetization of the S=1/2 bond-alternating XY model in the Random magnetic field along the z-direction having the Lorentzian distribution. The random-averaged free energy can be…

Strongly Correlated Electrons · Physics 2015-10-28 Kiyomi Okamoto

With use of homogeneous model for magnetic sub-lattice of compound La1-x CaxMnO3 allowing for Heisenberg superexchange and double exchange between nearest neighbors the temperature dependence of spontaneous magnetization on a separate site…

Strongly Correlated Electrons · Physics 2007-05-23 B. V. Karpenko , L. D. Falkovskaya , A. V. Kuznetsov

Pinning interactions between superconducting vortices in Nb and magnetic Ni dots were studied as a function of current and temperature to clarify the nature of pinning mechanisms. A strong current dependence is found for a square array of…

Superconductivity · Physics 2009-10-31 J. I. Martin , M. Velez , A. Hoffmann , I. K. Schuller , J. L. Vicent

We present a first-principles investigation of magnetic exchange interactions and critical behavior in (111)-oriented (LaMnO$_3$)$_{2n}$|(SrMnO$_3$)$_n$ superlattices for $n=2,4,6$. For all superlattices under investigation, we find robust…

Strongly Correlated Electrons · Physics 2026-02-17 Shivalika Sharma , Julio do Nascimento , Imran Ahamed , Fabrizio Cossu , Heung-Sik Kim , Igor Di Marco

We study the exchange interactions in half-metallic Heusler alloys using first-principles calculations in conjunction with the frozen-magnon approximation. The Curie temperature is estimated within both mean-field (MF) and…

Materials Science · Physics 2009-11-11 E. Sasioglu , L. M. Sandratskii , P. Bruno , I. Galanakis

Finite temperature effects have a pronounced impact on the transport properties of solids. In magnetic systems, besides the scattering of conduction electrons by impurities and phonons, an additional scattering source coming from the…

Materials Science · Physics 2017-03-15 Kristina Chadova , Sergiy Mankovsky , Jan Minár , Hubert Ebert

Spin qubits associated with color centers are promising platforms for various quantum technologies. However, to be deployed in robust quantum devices, the variations of their intrinsic properties with the external conditions, and in…

Quantum Physics · Physics 2022-09-08 Hao Tang , Ariel Rebekah Barr , Guoqing Wang , Paola Cappellaro , Ju Li

We model changes of magnetic ordering in Mn-antiperovskite nitrides driven by biaxial lattice strain at zero and at finite temperature. We employ a non-collinear spin-polarised density functional theory to compare the response of the…

Strongly Correlated Electrons · Physics 2017-06-07 J. Zemen , E. Mendive Tapia , Z. Gercsi , R. Banerjee , C. E. Patrick , J. B. Staunton , K. G. Sandeman

The exchange coupling of two magnetic layers via a diffuse oxide interlayer is studied with an atomistic spin model. We investigate the effect of magnetic concentration and oxide layer thickness on the effective exchange coupling strength…

Materials Science · Physics 2015-06-22 R. F. L. Evans , Q. Coopman , S. Devos , W. J. Fan , O. Hovorka , R. W. Chantrell

We use supercell and frozen-magnon approaches to study the dependence of the magnetic interactions in (Ga,Mn)As on the Mn concentration. We report the parameters of the exchange interaction between Mn spins and the estimates of the Curie…

Materials Science · Physics 2009-11-07 L. M. Sandratskii , P. Bruno
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