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By performing accurate ab-initio density functional theory calculations, we study the role of $4f$ electrons in stabilizing the magnetic-field-induced ferroelectric state of DyFeO$_{3}$. We confirm that the ferroelectric polarization is…

材料科学 · 物理学 2015-05-14 Alessandro Stroppa , Martijn Marsman , Georg Kresse , Silvia Picozzi

From magnetic susceptibility, dielectric permittivity, electric polarization and specific heat measurements, we discover spin-induced ferroelectricity and magnetoelectric coupling in Mn3TeO6 and observe two successive magnetic transitions…

材料科学 · 物理学 2015-12-01 L. Zhao , Z. Hu , C. Y. Kuo , T. -W. Pi , M. -K. Wu , L. H. Tjeng , A. C. Komarek

We report a phenomenological magneto-structural model based on competing free-energy terms that couple either polar or chiral distortions in cubic quadruple perovskites, depending on the global direction of magnetic moments. The model…

Noncollinear ferroic materials are sought after as testbeds to explore the intimate connections between topology and symmetry, which result in electronic, optical and magnetic functionalities not observed in collinear ferroic materials. For…

Multiferroics are a unique class of materials where magnetic and ferroelectric orders coexist. The research on multiferroics contributes significantly to the fundamental understanding of the strong correlations between different material…

材料科学 · 物理学 2021-11-03 A. C. Garcia-Castro , Yanjun Ma , Zachary Romestan , Eric Bousquet , Cheng Cen , Aldo H. Romero

ABO3 perovskite multiferroic La0.5Bi0.5Mn0.5Fe0.5O3.09 where the B-site cations is responsible for the magnetic properties and the A-site cation with lone pair electron is responsible for the ferroelectric properties was synthesized at…

材料科学 · 物理学 2008-08-25 Asish K. Kundu , R. Ranjith , V. Pralong , N. Nguyen , B. Kundys , V. Caignaert , W. Prellier , B. Raveau

Perovskite manganites with small A-site ions, as the first and canonical branch of type-II multiferroics, are ideal systems to exhibit magnetism-induced ferroelectricity. Despite their established magnetoelectric phase diagrams under low…

材料科学 · 物理学 2026-01-15 Ming Yang , Jun Chen , Junfeng Wang , Chao Dong , Chengliang Lu , Gang Xu , Jinguang Cheng , Jianshi Zhou , Shuai Dong

We use density-functional theory with the local-density approximation to study the structural and ferroelectric properties of SrTiO$_3$ under misfit strains. Both the antiferrodistortive (AFD) and ferroelectric (FE) instabilities are…

材料科学 · 物理学 2009-11-11 Chien-Hung Lin , Chih-Meng Huang , G. Y. Guo

We present a first-principles scheme for computing the magnetoelectric response of multiferroics. We apply our method to BiFeO3 (BFO) and related compounds in which Fe is substituted by other magnetic species. We show that under certain…

材料科学 · 物理学 2012-04-17 Jacek C. Wojdel , Jorge Iniguez

First-principles density functional calculations show that the $\textrm{SrRuO}_{3}/\textrm{PbTiO}_{3}/\textrm{SrRuO}_{3}$ multiferroic junction with asymmetric (RuO$_{2}$/PbO and TiO$_{2}$/SrO) interfaces has a large ferroelectric…

材料科学 · 物理学 2013-12-20 Francesco Ricci , Alessio Filippetti , Vincenzo Fiorentini

Magnetoelectric multiferroic composite of two types of multiferroic (Type I and II) consisting BiFeO3 and TbMnO3 is studied for enhanced magnetic and transport properties. A narrower band gap is estimated from the UV-visible absorption…

Magnetic phase transitions in multiferroic bismuth ferrite (BiFeO3) induced by magnetic field, epitaxial strain, and composition modification are considered. These transitions from a spatially modulated spin spiral state to a homogenous…

强关联电子 · 物理学 2008-12-28 A. M. Kadomtseva , Yu. F. Popov , A. P. Pyatakov , G. P. Vorob'ev , A. K. Zvezdin , D. Viehland

We report the effect of Ba and Zr co-substitution on structural, dielectric, magnetic and magnetoelectric properties of BiFeO3 multiferroics. Polycrystalline nanoceramic samples of Bi1- xBaxFe1-yZryO3 have been synthesized by…

材料科学 · 物理学 2019-09-17 Satya Tripathy , Dhiren Pradhan , S Sen , BG Mishra , R Palai , JF Scott , R. S. Katiyar , Dillip pradhan

Wurtzite-type nitrides have recently emerged as promising candidates for ferroelectric applications, yet their magnetic counterparts remain largely unexplored. Here, we establish MnSiN$_2$ and MnGeN$_2$ as aristotypes of a new multiferroic…

材料科学 · 物理学 2025-09-09 Steven M. Baksa , Lin-Ding Yuan , Stephen D. Wilson , James M. Rondinelli

By combining bulk properties, neutron diffraction and non-resonant X-ray diffraction measurements, we demonstrate that the new multiferroic Cu$_3$Nb$_2$O$_8$ becomes polar simultaneously with the appearance of generalised helicoidal…

Using density-functional theory calculations and experimental investigations on structural, magnetic and dielectric properties, we have elucidated a unique tetragonal ground state for MnTi2O4, a Ti^{3+} (3d^1)-ion containing spinel-oxide.…

强关联电子 · 物理学 2019-10-09 A. Rahaman , M. Chakraborty , T. Paramanik , R. K. Maurya , S. Mahana , R. Bindu , D. Topwal , P. Mahadevan , D. Choudhury

$\text{BiFeO}_\text{3}$ has drawn a great attention over last several decades due to its promising multiferroic character. In the ground state the bulk $\text{BiFeO}_\text{3}$ is found to be in the rhombohedral phase. However, it has been…

材料科学 · 物理学 2022-01-24 Soumyasree Jena , Sanchari Bhattacharya , Sanjoy Datta

Electric-field controlled exchange bias in a heterostructure composed of the ferromagnetic manganite La0.7Sr0.3MO3 and the ferroelectric antiferromagnetic BiFeO3 has recently been demonstrated experimentally. By means of a microscopic model…

强关联电子 · 物理学 2011-07-19 M. J. Calderon , S. Liang , R. Yu , J. Salafranca , S. Dong , S. Yunoki , L. Brey , A. Moreo , E. Dagotto

Magnetoelectric multiferroics, materials with intrinsically coupled electric polarization and magnetic order, promise ultralow-power switching, nonvolatile memory, and energy-efficient signal transduction. Yet practical deployment demands…

The existence of ferroelectricity in {$\mathrm{BiMnO}_3$} has been a long-standing question for both experimentalists and theorists. In addition to a highly distorted bulk structure, the ionic crystal planes cause a large roughness in thin…

材料科学 · 物理学 2017-04-11 Yun-Peng Wang , J. N. Fry , Hai-Ping Cheng