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Recent investigations suggest that both spin-orbit coupling and electron correlation play very crucial roles in the $5d$ transition metal oxides. By using the generalized Gutzwiller variational method and dynamical mean-field theory with…

强关联电子 · 物理学 2015-06-12 Liang Du , Li Huang , Xi Dai

We calculate Heisenberg-type magnetic exchange interactions for SrMnO$_3$ under isotropic volume expansion using an approach that is based on total energy variations due to infinitesimal spin rotations around a given reference state. Our…

材料科学 · 物理学 2020-02-12 Xiangzhou Zhu , Alexander Edström , Claude Ederer

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…

Starting from the Mott insulator picture for cubic vanadates, we derive and investigate the model of superexchange interactions between V$^{3+}$ ions, with nearly degenerate $t_{2g}$ orbitals occupied by two electrons each. The…

强关联电子 · 物理学 2007-06-19 Andrzej M. Oles , Peter Horsch , Giniyat Khaliullin

Spin reorientation and magnetisation reversal are two important features of the rare-earth orthorhombic provskites ($RM$O$_{3}$'s) that have attracted a lot of attention, though their exact microscopic origin has eluded researchers. Here,…

材料科学 · 物理学 2021-08-25 Alireza Sasani , Jorge Iñiguez , Eric Bousquet

This paper is an overview of some recent work done on the double perovskites. We discuss the physics of selected double perovskite compounds emphasizing the relevant interactions and resulting observable phenomena such as the magnetic order…

强关联电子 · 物理学 2025-09-03 Gayanath W. Fernando , Saikat Banerjee , R. Matthias Geilhufe

We study the magnetic orbital response of a system of N interacting electrons confined in a two-dimensional geometry and subjected to a perpendicular magnetic field in the finite temperature Hartree-Fock approximation. The electron-electron…

介观与纳米尺度物理 · 物理学 2009-01-23 L. G. G. V. Dias da Silva , Caio H. Lewenkopf , Nelson Studart

Complex oxide thin films and heterostructures offer a wide range of properties originating from the intrinsic coupling between lattice strain and magnetic/electronic ordering. This article reviews experimental, phenomenological, and…

强关联电子 · 物理学 2023-10-20 Surendra Singh

Exchange bias properties are observed in a double perovskite compound, Sr2LuRuO6. The observed exchange bias properties have been analyzed on the basis of some of the available theoretical models. Detailed magnetization measurements show…

强关联电子 · 物理学 2010-09-17 Ravi. P. Singh , C. V. Tomy

In this paper, we examine the properties of spin-polarized interfaces consisting of single-molecule magnet bis(cyclopentadienyl)cobalt(II) (cobaltocene) and two-dimensional magnetic materials, semiconducting CrI$_3$ and metallic…

材料科学 · 物理学 2026-03-23 Nikola Machacova , Biplab Sanyal

Roles of orbital and lattice degrees of freedom in strongly correlated systems are investigated to understand electronic properties of perovskite Mn oxides such as La_{1-x}Sr_{x}MnO_{3}. An extended double-exchange model containing Coulomb…

强关联电子 · 物理学 2007-05-23 Yukitoshi Motome , Masatoshi Imada

We have studied the effect of local Coulomb interactions on the electronic structure of the molecular magnet Mn12-acetate within the LDA+U approach. The account of the on-site repulsion results in a finite energy gap and an integer value of…

介观与纳米尺度物理 · 物理学 2009-11-07 D. W. Boukhvalov , A. I. Lichtenstein , V. V. Dobrovitski , M. I. Katsnelson , B. N. Harmon , V. V. Mazurenko , V. I. Anisimov

Recent experiments have shown that some colossal magnetoresistance (CMR) materials exhibit a percolation transition. The conductivity exponent varies substantially with or without an external magnetic field. This finding prompted us to…

强关联电子 · 物理学 2009-11-07 Ye Xiong , Shun-Qing Shen , X. C. Xie

Basic mechanisms controlling orbital order and orbital fluctuations in transition metal oxides are discussed. The lattice driven classical orbital picture, e.g. like in manganites LaMnO$_3$, is contrasted to the quantum behavior of orbitals…

强关联电子 · 物理学 2009-11-11 Giniyat Khaliullin

Magnetite, a naturally abundant mineral, frequently interacts with water in both natural settings and various technical applications, making the study of its surface chemistry highly relevant. In this work, we investigate the hydrogen…

The layered perovskites $R$Cr(BO$_3$)$_2$ ($R$ = Y and Ho) with magnetic triangular lattices were studied by performing ac/dc susceptibility, specific heat, elastic and inelastic neutron scattering, and dielectric constant measurements. The…

材料科学 · 物理学 2017-09-13 R. Sinclair , H. D. Zhou , M. Lee , E. S. Choi , G. Li , T. Hong , S. Calder

Using density functional theory plus Hubbard-U (DFT+U) approach, we find that quasi one-dementation(1D) 3d transition metal(TM) zigzag nanowire can be constructed by TM adsorbed on the surface of graphyne sheet. The results show that the TM…

材料科学 · 物理学 2013-05-22 Junjie He , Pan Zhou , N. Jiao , S. Y. Ma , K. W. Zhang , R. Z. Wang , L. Z. Sun

We propose a class of topological metals, which we dub \emph{Hund nodal line semimetals}, arising from the strong Coulomb interaction encoded in the Hund's coupling between itinerant electrons and localized spins. We here consider a…

介观与纳米尺度物理 · 物理学 2019-01-30 R. Matthias Geilhufe , Francisco Guinea , Vladimir Juricic

Perpendicular magnetic anisotropy (PMA) and Dzyaloshinskii-Moriya interactions are key interactions in modern spintronics. These interactions are thought to be dominated by the oxidation of the Co|Al interface in the archetypal…

We theoretically investigate the magneto-optical (MO) properties of monolayer (ML) transition metal dichalcogenides (TMDs) in the presence of external electrical and quantizing magnetic fields and of the proximity-induced exchange…

介观与纳米尺度物理 · 物理学 2024-11-05 Y. Li , Y. M. Xiao , W. Xu , L. Ding , M. V. Milošević , F. M. Peeters
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