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We report on a density functional theory study demonstrating the coexistence of weak ferromagnetism and antiferroelectricity in boron-deficient MgB6. A boron vacancy produces an almost one dimensional extended molecular orbital, which is…

Materials Science · Physics 2012-03-09 Igor Popov , Nadjib Baadji , Stefano Sanvito

We report the direct measurement of antiferromagnetic spin polarization at the oxygen sites in the multiferroic TbMn2O5, through resonant soft x-ray magnetic scattering. This supports recent theoretical models suggesting that the oxygen…

Recent data reported on the magneto-electric coupling,{\alpha}, of hexaferrite materials is very high, and they have the potential to impact future technologies in a major way. The fundamental question addressed in this paper is what does…

Materials Science · Physics 2014-04-23 Carmine Vittoriaa , Somu Sivasubramanianb , Allan Widomc

Electric field control of magnetic structures, particularly topological defects in magnetoelectric materials, draws a great attention in recent years, which has led to experimental success in creation and manipulation by electric field of…

Strongly Correlated Electrons · Physics 2017-05-24 P. I. Karpov , S. I. Mukhin

In heavy-fermion compounds, the dual character of $f$ electrons underlies their rich and often exotic properties like fragile heavy quasipartilces, variety of magnetic orders and unconventional superconductivity. 5$f$-electron actinide…

Strongly Correlated Electrons · Physics 2019-09-13 Q. Y. Chen , X. B. Luo , D. H. Xie , M. L. Li , X. Y. Ji , R. Zhou , Y. B. Huang , W. Zhang , W. Feng , Y. Zhang , X. G. Zhu , Q. Q. Hao , Q. Liu , L. Huang , P. Zhang , X. C. Lai , Q. Si , S. Y. Tan

The altermagnetism with antiparallel spin alignment exhibits anisotropic spin splitting and may possess an insulating state with a high Neel temperature, while the charge-order-induced ferroelectricity has ultrafast electric polarization…

Materials Science · Physics 2026-03-25 Yuhao Gu , Yu-Hui Song , Yihao Wang , Ze-Feng Gao , Huan-Cheng Yang , Peng-Jie Guo , Zhong-Yi Lu

Quantum electronic fluids with spin and valley degrees of freedom have a correlation driven tendency to flavor polarization (generalized ferromagnetism). To first order in the long-range Coulomb interactions -- i.e. in the Hartree-Fock…

Strongly Correlated Electrons · Physics 2025-07-09 Vladimir Calvera , Erez Berg , Steven A. Kivelson

The structural, electronic and lattice dielectric properties of multiferroic TbMn$_2$O$_5$ are investigated using density functional theory within the generalized gradient approximation (GGA). We use collinear spin approximations and ignore…

Materials Science · Physics 2009-11-13 Chenjie Wang , Guang-Can Guo , Lixin He

Using a joint approach of density functional theory and model calculations, we demonstrate that a prototypical charge ordered half-doped manganite, La$_{1/2}$Ca$_{1/2}$MnO$_3$ is multiferroic. The combination of a peculiar charge-orbital…

Materials Science · Physics 2010-07-15 Gianluca Giovannetti , Sanjeev Kumar , Jeroen van den Brink , Silvia Picozzi

We extend a microscopic theory of polarization and magnetization to include the spin degree of freedom of the electrons, introducing a general spin orbit coupling and Zeeman interaction term in the Hamiltonian. At finite frequencies and…

Mesoscale and Nanoscale Physics · Physics 2023-07-11 Alistair H. Duff , J. E. Sipe

To understand the collinear-magnetism-driven ferroelectricity in multiferroic Ca3CoMnO6 compound, we have established an elastic diatomic Ising spin-chain model with axial-next-nearest-neighbor interaction to describe its magnetoelectric…

Statistical Mechanics · Physics 2016-03-23 Yan Qi , Qi Yang , Nai-sen Yu , An Du

Multiferroics, where two or more ferroic order parameters coexist, is one of the hottest fields in condensed matter physics and materials science[1-9]. However, the coexistence of magnetism and conventional ferroelectricity is physically…

Materials Science · Physics 2016-03-11 Xiangang Wan , Hang-Chen Ding , Sergey Y. Savrasov , Chun-Gang Duan

We present an approach for first principles investigations on the spin driven electric polarization in type II multiferroics. We propose a parametrization of the polarization with the parameters calculated using the Korringa-Kohn-Rostoker…

Materials Science · Physics 2025-12-02 Sergiy Mankovsky , Svitlana Polesya , Jan Minar , Hubert Ebert

We study in this paper bond distortion effect on electric polarization in spiral multiferroic magnets based on cluster and chain models. The bond distortion break inversion symmetry and modify the $d$-$p$ hybridization. Consequently, it…

Strongly Correlated Electrons · Physics 2015-06-04 Hong-Bo Chen , Yi Zhou , You-Quan Li

New insights into the microscopic origin of itinerant ferromagnetism were recently gained from investigations of electronic lattice models within dynamical mean-field theory (DMFT). In particular, it is now established that even in the…

Strongly Correlated Electrons · Physics 2007-05-23 D. Vollhardt , N. Blümer , K. Held , M. Kollar

We study the magnetocapacitance (MC) effect and magnetoelectric (ME) coupling in spin-flop driven antiferromagnet Co4Ta2O9. The magnetocapacitance data at high magnetic fields are analyzed by phenomenological Ginzburg-landau theory of…

Materials Science · Physics 2017-07-12 S. Chaudhary , P. Srivastava , S. Patnaik

A detailed investigation of the out-of-plane electrical properties of charge-ordered alpha-(BEDT-TTF)2I3 provides clear evidence for ferroelectricity. Similar to multiferroic alpha-(BEDT-TTF)2Cu[N(CN)2]Cl, the polar order in this material…

Strongly Correlated Electrons · Physics 2015-06-22 P. Lunkenheimer , B. Hartmann , M. Lang , J. Müller , D. Schweitzer , S. Krohns , A. Loidl

An appealing mechanism for inducing multiferroicity in materials is the generation of electric polarization by a spatially varying magnetization that is coupled to the lattice through the spin-orbit interaction. Here we describe the…

In this contribution to the special issue on multiferroics we focus on multiferroicity driven by different forms of charge ordering. We will present the generic mechanisms by which charge ordering can induce ferroelectricity in magnetic…

Materials Science · Physics 2011-07-22 Jeroen van den Brink , Daniel I. Khomskii

Recent observations of unusual ferroelectricity in thin films of HfO_2 and related materials have attracted broad interest to the materials and led to the emergence of a number of competing models for observed behaviors. Here we develop the…

Materials Science · Physics 2018-11-27 Maya D. Glinchuk , Anna N. Morozovska , Yunseok Kim , Sergei V. Kalinin
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