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The superexchange theory predicts dominant antiferromagnetic kinetic interaction when the orbitals accommodating magnetic electrons are covalently bonded through diamagnetic bridging atoms/groups. Here we show that explicit consideration of…

Strongly Correlated Electrons · Physics 2020-09-23 Zhishuo Huang , Dan Liu , Akseli Mansikkamäki , Veacheslav Vieru , Naoya Iwahara , Liviu F. Chibotaru

Density-functional calculations are carried out to investigate incommensurate magnetic structures and ferroelectric polarization in newly discovered multiferroic material MnI$_2$. The exchange interactions among local moments on Mn are…

Strongly Correlated Electrons · Physics 2013-05-30 Xianxin Wu , Yingxiang Cai , Qing Xie , Hongming Weng , Heng Fan , Jiangping Hu

Heterostructures from complex oxides allow one to combine various electronic and magnetic orders as to induce new quantum states. A prominent example is the coupling between superconducting and magnetic orders in multilayers from high-Tc…

The Hubbard model has been employed successfully to understand many aspects of correlation driven physical properties, in particular, the magnetic order in itenerant electron systems. In some systems such as Heusler alloys, manganites etc.,…

Strongly Correlated Electrons · Physics 2015-05-18 L. Haritha , G. Gangadhar Reddy , A. Ramakanth , S. K. Ghatak , W. Nolting

We present an analytical study of the exchange interactions between pseudospin one-half $d^{5}$ ions in honeycomb lattices with edge-shared octahedra. Various exchange channels involving Hubbard U, charge-transfer excitations, and cyclic…

Strongly Correlated Electrons · Physics 2022-06-10 Huimei Liu , Jiri Chaloupka , Giniyat Khaliullin

Oxide double perovskites wherein octahedra formed by both 3d elements and sp-based heavy elements give rise to unconventional magnetic ordering and correlated quantum phenomena crucial for futuristic applications. Here, by carrying out…

Strongly Correlated Electrons · Physics 2021-03-30 J. Khatua , T. Arh , Shashi B. Mishra , H. Luetkens , A. Zorko , B. Sana , M. S. Ramachandra Rao , B. R. K. Nanda , P. Khuntia

We describe an ab-initio disordered local moment theory for long period magnetic phases and investigate the temperature and magnetic field dependence of the magnetic states in the heavy rare earth elements (HRE), namely paramagnetic,…

Strongly Correlated Electrons · Physics 2017-05-17 Eduardo Mendive Tapia , Julie B. Staunton

Hexagonal MnTe emerges as a critical component in designing magnetic quantum heterostructures, calling for a detailed study. After finding a suitable combination of exchange-correlation functional and corrections, our study within {\em ab…

Materials Science · Physics 2024-01-30 Suman Rooj , Jayita Chakraborty , Nirmal Ganguli

We investigate in this paper the ground state and the nature of the transition from an orientational ordered phase at low temperature to the disordered state at high temperature in a molecular crystal. Our model is a Potts model which takes…

Statistical Mechanics · Physics 2015-06-03 Danh-Tai Hoang , H. T. Diep

It is shown that interlayer spin-singlet Cooper pairing is induced by magnetic interactions in a metallic antiferromagnet of stacked conductive layers in which each layer is ferromagnetically polarized and they order antiferromagnetically…

Superconductivity · Physics 2007-05-23 Hiroshi Shimahara

We study the multipole interactions between $f^2$ ions with the $\Gamma_3$ non-Kramers doublet ground state under a cubic crystalline electric field. We construct the $\Gamma_3$ doublet state of the electrons with the total angular momentum…

Strongly Correlated Electrons · Physics 2017-02-23 Katsunori Kubo , Takashi Hotta

Motivated by recent experiments exploring the spin-orbit-coupled magnetism in $4d$- and $5d$-band transition metal oxides, we study magnetic interactions in Ir- and Rh-based compounds. In these systems, the comparable strength of spin-orbit…

Strongly Correlated Electrons · Physics 2015-06-17 Natalia B. Perkins , Yuriy Sizyuk , Peter Wölfle

The Ising exchange interaction is a limiting case of strong exchange anisotropy and represents a key property of many magnetic materials. Here we find necessary and sufficient conditions to achieve Ising exchange interaction for metal sites…

Strongly Correlated Electrons · Physics 2015-10-15 Liviu F. Chibotaru , Naoya Iwahara

Magnetic refrigeration based on the magnetocaloric effect (MCE) of materials is a potential technique that has prominet advantages over the currently used gas compression-expansion technique in the sense of its high efficiency and…

Materials Science · Physics 2023-10-18 B. G. Shen , J. R. Sun , F. X. Hu , H. W. Zhang , Z. H. Cheng

Ordered states for a classical Heisenberg model on fcc lattice structure with ABC stacked kagome planes of magnetic ions are investigated by numerically solving the Landau-Lifshitz (LL) equation. Both the nearest-neighbor exchange…

Statistical Mechanics · Physics 2024-07-31 Terufumi Yokota

In recent decades, novel magnetism of $d$- and $f$-electron compounds has been discussed very intensively both in experimental and theoretical research fields of condensed matter physics. It has been recognized that those material groups…

Strongly Correlated Electrons · Physics 2009-11-11 Takashi Hotta

We show that the magnetism of double perovskite AFe_{1/2}M_{1/2}O_3 systems may be described by the Heisenberg model on the simple cubic lattice, where only half of sites are occupied by localized magnetic moments. The nearest-neighbor…

Materials Science · Physics 2015-01-16 R. O. Kuzian , I. V. Kondakova , A. -M. Dare , V. V. Laguta

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…

The double-exchange model for the Mn oxides with orbital degeneracy is studied with including on-site Coulomb repulsion, Jahn-Teller (J-T) coupling and doping-induced disorder. In the strong interaction limit, it is mapped onto a…

Strongly Correlated Electrons · Physics 2009-10-31 L. Sheng , D. N. Sheng , C. S. Ting

A ferromagnetic insulating (FM-I) state in Pr0.75Ca0.25MnO3 has been studied by neutron scattering experiment and theoretical calculation. The insulating behavior is robust against an external magnetic field, and is ascribed to neither the…

Strongly Correlated Electrons · Physics 2009-11-10 R. Kajimoto , H. Mochizuki , H. Yoshizawa , S. Okamoto , S. Ishihara
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