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Inelastic neutron scattering (INS) provides direct insights into microscopic magnetic interactions in crystalline materials, making it a valuable experimental technique in condensed matter physics and materials science. These interactions…

Materials Science · Physics 2025-09-23 Mojtaba Alaei , Zahra Mosleh , Nafise Rezaei , Artem R. Oganov

Using fully self-consistent thermal broken-symmetry GW we construct effective magnetic Heisenberg Hamiltonians for a series of transition metal oxides (NiO, CoO, FeO, MnO), capturing a rigorous but condensed description of the magnetic…

Materials Science · Physics 2023-03-22 Pavel Pokhilko , Dominika Zgid

MnSb$_{2}$O$_{6}$ is based on the noncentrosymmetric $P321$ space group with magnetic Mn$^{2+}$ ($S={5/2}$, $L\approx 0$) spins ordering below $T_{\mathrm{N}}=12$ K in a helicoidal structure. The ground state magnetic structure, expected to…

We investigate spin dynamics in $\alpha$-Fe$_{2}$O$_{3}$/Ni$_{80}$Fe$_{20}$ (Py) heterostructures, uncovering a robust mechanism for in-situ modulation of ferromagnetic resonance (FMR) through precise control of temperature, applied…

We consider a mesoscopic mechanism of the exchange interaction in a system of alternating ferromagnetic/nonmagnetic metallic layers. In the case of small mesoscopic samples the sign and the amplitude of the exchange energy turn out to be…

Condensed Matter · Physics 2007-05-23 B. Spivak , A. Zyuzin

We present a rotationally invariant Hirsch-Fye quantum Monte Carlo algorithm in which the spin rotational invariance of Hund's exchange is approximated by averaging over all possible directions of the spin quantization axis. We employ this…

Strongly Correlated Electrons · Physics 2013-04-15 A. S. Belozerov , I. Leonov , V. I. Anisimov

An extensive Monte Carlo study of the classical Heisenberg model on a simple cubic lattice with antiferromagnetic exchange interactions $J_n$ between the first, second, and third neighbors is performed in a broad region of $J_2 / J_1$, $J_3…

Strongly Correlated Electrons · Physics 2026-02-26 A. N. Ignatenko , S. V. Streltsov , V. Yu. Irkhin

The exchange interactions and magnetic structure in layered system CuMnO2 (mineral crednerite) and in nonstoichiometric system Cu1.04Mn0.96O2, with triangular layers distorted due to orbital ordering of the Mn3+ ions, are studied by…

Strongly Correlated Electrons · Physics 2014-01-21 A. V. Ushakov , S. V. Streltsov , D. I. Khomskii

We analyze possible ways to calculate magnetic exchange interactions within the density functional theory plus dynamical mean-field theory (DFT+DMFT) approach in the paramagnetic phase. Using the susceptibilities obtained within the ladder…

Strongly Correlated Electrons · Physics 2023-06-09 A. A. Katanin , A. S. Belozerov , A. I. Lichtenstein , M. I. Katsnelson

We examine the temperature dependence of thermopower in the single band Hubbard model using dynamical mean-field theory. The strong Coulomb interaction brings about the coherent-to-incoherent crossover as temperature increases. As a result,…

Strongly Correlated Electrons · Physics 2011-11-08 M. Matsuo , S. Okamoto , W. Koshibae , M. Mori , S. Maekawa

Using the Kondo lattice model with classical spins in infinite dimension, magnetic phase transition in the perovskite-type $3d$ transition-metal oxide (La,Sr)MnO$_3$ is theoretically studied. On the Bethe lattice, the self-consistency…

Condensed Matter · Physics 2016-08-31 Nobuo Furukawa

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

This article gives a comprehensive review on the recent studies of the double exchange systems using non-perturbative approaches; the dynamical mean-field theory and the Monte Carlo method. Investigations beyond mean-field type treatments…

Strongly Correlated Electrons · Physics 2007-05-23 N. Furukawa

We present a study of the spin-1/2 Heisenberg chain with alternating ferro- and antiferromagnetic exchange, focusing on the role of the exchange couplings to cover both, dimer and Haldane limit. Employing a complementary combination of…

Strongly Correlated Electrons · Physics 2020-01-15 Niklas Casper , Wolfram Brenig

Electric field control of the exchange bias effect across ferromagnet/antiferromagnet (FM/AF) interfaces has offered exciting potentials for low-energy-dissipation spintronics. In particular, the solid state magneto-ionic means is highly…

In this paper we present an accurate numerical scheme for extracting inter-atomic exchange parameters ($J_{ij}$) of strongly correlated systems, based on first-principles full-potential electronic structure theory. The electronic structure…

Strongly Correlated Electrons · Physics 2015-03-11 Y. O. Kvashnin , O. Grånäs , I. Di Marco , M. I. Katsnelson , A. I. Lichtenstein , O. Eriksson

We study the influence of ferromagnetic nonlocal exchange on correlated electrons in terms of a $SU(2)$-Hubbard-Heisenberg model and address the interplay of on-site interaction induced local moment formation and the competition of…

Strongly Correlated Electrons · Physics 2020-07-01 Edin Kapetanović , Malte Schüler , Gerd Czycholl , Tim O. Wehling

This study presents the effect of local electronic correlations on the Heusler compounds Co$_2$Mn$_{1-x}$Fe$_x$Si as a function of the concentration $x$. The analysis has been performed by means of first-principles band-structure…

Strongly Correlated Electrons · Physics 2009-04-22 S Chadov , G. H. Fecher , C. Felser , J. Minár , J. Braun , H. Ebert

We propose a self-consistent method for electronic structure calculations of correlated systems, which combines the local spin-density approximation (LSDA) and the dynamical mean field theory (DMFT). The LSDA part is based on the exact…

Strongly Correlated Electrons · Physics 2007-05-23 L. Chioncel , L. Vitos , I. A. Abrikosov , J. Kollar , M. I. Katsnelson , A. I. Lichtenstein

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