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We report the parameter-free, density functional theory calculations of interatomic exchange interactions and Curie temperatures of half-metallic ferrimagnetic full Heusler alloys Mn2VZ (Z=Al, Ge). To calculate the interatomic exchange…

Materials Science · Physics 2007-05-23 E. Sasioglu , L. M. Sandratskii , P. Bruno

The Heusler compounds Mn$_2$TiZ (Z = Al, Ga, In, Si, Ge, Sn, P, As, Sb) are of large interest due to their potential ferrimagnetic properties and high spin polarization. Here, we present calculations of the structural and magnetic…

Materials Science · Physics 2011-01-05 Markus Meinert , Jan-Michael Schmalhorst , Günter Reiss

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

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

The pressure dependence of electronic structure, exchange interactions and Curie temperature in ferromagnetic Heusler alloy Ni2MnSn has been studied theoretically within the framework of the density-functional theory. The calculation of the…

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

We study the interatomic exchange interactions and Curie temperatures in half-metallic semi Heusler compounds NiCrZ (Z=P, Se, Te) and NiVAs. The study is performed within the framework of density functional theory. The calculation of…

Materials Science · Physics 2015-06-25 E. Sasioglu , L. M. Sandratskii , P. Bruno

We performed first-principles calculations at finite temperatures to investigate the temperature dependence of the magnetic properties, such as exchange stiffness constants and Curie temperatures, of Co2MnZ (Z= Si, Al) assuming L21 and B2…

Materials Science · Physics 2025-07-30 Shogo Yamashita , Akimasa Sakuma , Mikihiko Oogane

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

Mn_2V_1-xCo_xZ (Z=Ga,Al and x=0, 0.25, 0.5, 0.75, 1) Heusler compounds have been synthesized to investigate the effect of Co substitution at the V site on the magnetic moment and Curie temperatures of half-metallic ferrimagnets Mn_2VGa and…

Materials Science · Physics 2017-10-30 Midhunlal P , Arout Chelvane J , Arjun Krishnan U M , Harish Kumar N

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

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

The exchange interactions of Cr4N, Mn4N, Fe4N, Co4N, and Ni4N compounds with perovskite structure were calculated to obtain the Curie temperatures for these compounds from Monte Carlo calculations. Contrary to naive expectation, the…

Materials Science · Physics 2016-01-15 Markus Meinert

Heusler alloys are promising for several applications, including magnetic refrigeration, due to high magnetocaloric and magnetovolume effects. One way to optimize this potential is by increasing the magnetovolume effect. Using density…

Materials Science · Physics 2016-12-30 J. N. Gonçalves , J. S. Amaral , V. S. Amaral

The superexchange intertacion in transition-metal oxides, proposed initially by Anderson in 1950, is treated using contemporary tight-binding theory and existing parameters. We find also a direct exchange for nearest-neighbor metal ions,…

Materials Science · Physics 2009-11-13 Walter A. Harrison

Using first-principles electronic structure calculations, we have studied the dependence of the Curie temperature on external hydrostatic pressure for random Ni2MnSn Heusler alloys doped with Cu and Pd atoms, over the entire range of dopant…

Materials Science · Physics 2011-12-01 S. K. Bose , J. Kudrnovsky , V. Drchal , I. Turek

Employing first-principles electronic structure calculations in conjunction with the frozen-magnon method we study the effective exchange interactions and spin waves in local moment ferromagnets. As prototypes we have chosen three…

Materials Science · Physics 2012-10-30 I. Galanakis , E. Sasioglu

We have calculated Heisenberg exchange parameters for bcc-Fe, fcc-Co, and fcc-Ni using the scalar-relativistic spin-polarized Green function technique within the tight-binding linear muffin-tin orbital method and by employing the magnetic…

Mesoscale and Nanoscale Physics · Physics 2009-10-31 Marek Pajda , Josef Kudrnovsky , Ilja Turek , Vaclav Drchal , Patrick Bruno

Because of large spatial separation of the Mn atoms in Heusler alloys the Mn 3d states belonging to different atoms do not overlap considerably. Therefore an indirect exchange interaction between Mn atoms should play a crucial role in the…

Materials Science · Physics 2009-11-13 E. Sasioglu , L. M. Sandratskii , P. Bruno

We present a semi-analytic theory for the Curie temperature in diluted magnetic semi-conductors that treats disorder effects exactly in the effective Heisenberg Hamiltonian, and spin fluctuations within a local RPA. The exchange couplings…

Disordered Systems and Neural Networks · Physics 2015-06-24 Georges Bouzerar , Timothy Ziman , Josef Kudrnovsky

We present calculations of the exchange interactions and Curie temperatures in Cr-based pnictides and chalcogenides of the form CrX with X=As, Sb, S, Se and Te, and the mixed alloys CrAs$_{50}$X$_{50}$ with X=Sb, S, Se, and Te. The…

Materials Science · Physics 2010-03-02 S. K. Bose , J. Kudrnovský
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