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The magnetic force theorem provides convenient ways to study exchange interactions in magnetic systems. However, it is well known that short range interactions in itinerant magnetic systems are poorly described with the conventional use of…

A novel approach to electronic correlations in magnetic crystals which takes into account a dynamical many-body effects is present. In order to to find a frequency dependence of the electron self energy, an effective quantum-impurity…

Strongly Correlated Electrons · Physics 2007-05-23 A. I. Lichtenstein , M. I. Katsnelson

The high-temperature ferromagnet MnBi continues to receive attention as a candidate to replace rare-earth-containing permanent magnets in applications above room temperature. This is due to a high Curie temperature, large magnetic moments,…

Strongly Correlated Electrons · Physics 2016-05-12 T. J. Williams , A. E. Taylor , A. D. Christianson , S. E. Hahn , R. S. Fishman , D. S. Parker , M. A. McGuire , B. C. Sales , M. D. Lumsden

In the framework of ab initio dynamical mean field theory for realistic electronic structure calculations a new perturbation scheme which combine the T-matrix and fluctuating exchange approximations has been proposed. This method is less…

Strongly Correlated Electrons · Physics 2009-11-07 M. I. Katsnelson , A. I. Lichtenstein

Some of the main experimental observations related to the occurrence of exchange bias in magnetic systems are reviewed, focusing the attention on the peculiar phenomenology associated to nanoparticles with core/shell structure as compared…

Materials Science · Physics 2008-06-20 Oscar Iglesias , Amilcar Labarta , Xavier Batlle

Exchange interactions between isolated pairs of spin centers in diamond have been calculated, based on an accurate atomistic electronic structure for diamond and any impurity atoms, for spin-center separations up to 2~nm. The exchange…

Mesoscale and Nanoscale Physics · Physics 2016-06-29 V. R. Kortan , C. Şahin , M. E. Flatté

The effect of orbital degrees of freedom on the exchange interactions in the spin-1 quasi-one-dimensional antiferromagnet CaV2O4 is systematically studied. For this purpose a realistic low-energy model with the parameters derived from the…

Materials Science · Physics 2015-06-23 Z. V. Pchelkina , I. V. Solovyev

We present a generalization of the spin-fluctuation theory of magnetism which allows us to treat the full rotational invariance of the exchange interaction. The approach is formulated in terms of the local density approximation plus…

Strongly Correlated Electrons · Physics 2012-09-26 V. I. Anisimov , A. S. Belozerov , A. I. Poteryaev , I. Leonov

We present the results of band structure calculations for ACr2X4 (A=Zn, Cd, Hg and X=O, S, Se) spinels. Effective exchange coupling constants between Cr spins are determined by fitting the energy of spin spirals to a classical Heisenberg…

Other Condensed Matter · Physics 2009-11-13 A. N. Yaresko

The large interest in chiral magnetic structures for realization of nanoscale magnetic storage or logic devices has necessitated methods which can quantify magnetic interactions at the atomic scale. To overcome the limitations of the…

This study examines the magnetic interactions between spatially-variable manganese and chromium trimers substituted into a graphene superlattice. Using density functional theory, we calculate the electronic band structure and magnetic…

We formulate a low-energy theory for the magnetic interactions between electrons in the multi-band Hubbard model under non-equilibrium conditions determined by an external time-dependent electric field which simulates laser-induced spin…

Strongly Correlated Electrons · Physics 2013-04-11 Andrea Secchi , Sergei Brener , Alexander I. Lichtenstein , Mikhail I. Katsnelson

We explored the magnetic behavior of a common two-phase nanomagnetic system by Monte Carlo computer simulation of a modified Heisenberg model on a 3D complex lattice with single- and cluster-spins. The effect of exchange coupling between…

Materials Science · Physics 2007-05-23 Y. Z. Shao , W. R. Zhong , G. M. Lin , X. D. Hu

Defects intentionally introduced into magnetic materials often have a profound effect on the physical properties. Specifically tailored neutron spectroscopic experiments can provide detailed information on both the local exchange…

Materials Science · Physics 2017-02-28 Albert Furrer

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 present a theoretical scheme to calculate the elastic constants of magnetic materials in the high-temperature paramagnetic state. Our approach is based on a combination of disordered local moments picture and ab initio molecular dynamics…

Materials Science · Physics 2016-08-24 Elham Mozafari , Nina Shulumba , Peter Steneteg , Björn Alling , Igor A. Abrikosov

A multi-high-frequency electron paramagnetic resonance method is used to probe the magnetic excitations of a dimer of single-molecule magnets. The measured spectra display well resolved quantum transitions involving coherent superposition…

Mesoscale and Nanoscale Physics · Physics 2016-08-31 S. Hill , R. S. Edwards , N. Aliaga-Alcalde , G. Christou

We present an ab initio method for eletcronic structure calculations, which accounts for the interaction of electrons and magnons in ferromagnets. While it is based on a many body perturbation theory we approximate numerically complex…

Materials Science · Physics 2023-04-19 S. Paischer , G. Vignale , M. I. Katsnelson , A. Ernst , P. Buczek

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

Tetragonal Mn-based Heusler compounds feature rich exchange interactions and exotic topological magnetic textures, such as antiskyrmions, complimented by the chiral-type Hall effects. This makes the material class interesting for device…