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It has been well established that both in bulk at ambient pressure and for films under modest strains, cubic SrCoO$_{3-\delta}$ ($\delta < 0.2$) is a ferromagnetic metal. Recent theoretical work, however, indicates that a magnetic phase…

材料科学 · 物理学 2015-06-23 S. J. Callori , S. Hu , J. Bertinshaw , Z. Yue , S. Danilkin , X. L. Wang , V. Nagarajan , F. Klose , J. Seidel , C. Ulrich

First-principles density-functional calculations reveal a large spin-phonon coupling in cubic SrMnO$_{3}$, with ferromagnetic ordering producing a polar instability. Through combination of this coupling with the strain-polarization coupling…

材料科学 · 物理学 2012-09-10 Jun Hee Lee , Karin M. Rabe

By using first-principles methods based on density functional theory we revisited the zero-temperature phase diagram of stoichiometric SrCoO3, a ferromagnetic metallic perovskite that undergoes significant structural, electronic, and…

材料科学 · 物理学 2016-12-21 Pablo Rivero , Claudio Cazorla

The complex nature of the magnetic ground state in La$_{1-x}$A$_{x}$CoO$_{3}$ (A = Ca, Sr, Ba) has been investigated via neutron scattering. It was previously observed that ferromagnetic (FM) as well as antiferromagnetic (AFM) correlations…

强关联电子 · 物理学 2015-05-18 Peng Tong , Juan Yu , Qingzhen Huang , Kazuyoshi Yamada , Despina Louca

From the spin polarized density functional total energy calculations, we shown that the ground state of cubic perovskite RbMnF$_3$ is an antiferromagnetic (AFM) insulator due to the super-exchange mechanism, in agreement with the other…

材料科学 · 物理学 2019-12-11 N. Tsogbadrakh , N. Tuvjargal , Chun Feng , J. Davaasambuu , O. Tegus

While polar metals are a metallic analogue of ferroelectrics, magnetic polar metals can be considered as a metallic analogue of multiferroics. There have been a number of attempts to integrate magnetism into a polar metal by synthesizing…

材料科学 · 物理学 2024-07-11 Zhiwei Liu , Qiuyue Li , Hanghui Chen

The mechanisms that drive metal-to-insulator transitions (MIT) in correlated solids are not fully understood. For example, the perovskite (PV) SrCoO3 is a FM metal while the oxygen-deficient (n-doped) brownmillerite (BM) SrCoO2.5 is an…

At ambient pressure, bulk SrCoO$_{3}$ is a ferromagnetic (FM) metal in cubic perovskite structure. By contrast, magnetic properties of epitaxial SrCoO$_{3}$ thin films, especially at high tensile strain ($\varepsilon \gtrsim 3$\%), remain…

材料科学 · 物理学 2022-11-21 Sheng-Chieh Huang , Kanchan Sarkar , Renata M. Wentzcovitch , Han Hsu

In the perovskite oxide SrCrO$_{3}$ the interplay between crystal structure, strain and orbital ordering enables a transition from a metallic to an insulating electronic structure under certain conditions. We identified a narrow window of…

First principles calculations are used to investigate the effects of epitaxial strain on the structure of the perovskite oxide CaTiO$_3$, with particular focus on the stabilization of a ferroelectric phase related to a polar instability…

材料科学 · 物理学 2013-05-29 C. -J. Eklund , C. J. Fennie , K. M. Rabe

We use symmetry analysis to show that the G, C and A-type antiferromagnetic Pnma perovskites can exhibit magnetoelectric (ME) responses when a ferroelectric instability is induced with epitaxial strain. Using first-principles calculations…

材料科学 · 物理学 2015-05-30 Eric Bousquet , Nicola Spaldin

The properties and mechanism of the magnetic phase transition of the perovskite-type Ti oxides, which is driven by the Ti-O-Ti bond angle distortion, are studied theoretically by using the effective spin and pseudospin Hamiltonian with…

强关联电子 · 物理学 2007-05-23 Masahito Mochizuki , Masatoshi Imada

Epitaxial strain has been shown to drive structural phase transitions along with novel functionalities in perovskite-based thin-films. Aliovalent doping at the A-site can drive an insulator-to-metal and magnetic transitions in perovskites…

材料科学 · 物理学 2019-09-11 Paresh Chandra Rout , Varadharajan Srinivasan

We identify a first-order, isosymmetric transition between a ferrielectric (FiE) and ferroelectric (FE) state in $A$-site ordered LaScO$_{3}$/BiScO$_{3}$ and LaInO$_{3}$/BiInO$_{3}$ superlattices. Such a previously unreported ferroic…

材料科学 · 物理学 2013-09-11 Gaoyang Gou , James M. Rondinelli

In half-doped Pr0.50A0.50CoO3 metallic perovskites, the spin-lattice coupling brings about distinct magnetostructural transitions for A=Ca and A=Sr at temperatures close to 100 K. However, the ground magnetic properties of Pr0.50Sr0.50CoO3…

A major challenge in condensed matter physics is integrating topological phenomena with correlated electron physics to leverage both types of states for next-generation quantum devices. Metal-insulator transitions (MITs) are central to…

Polarization induced spin switching of atoms in magnetic materials opens for possibilities to design and develop advanced spintronic devices, in particular, storage devices where the magnetic state can be controlled by an electric field. We…

材料科学 · 物理学 2018-10-09 Indukuru Ramesh Reddy , Peter M. Oppeneer , Kartick Tarafder

We investigate the effect of epitaxial strain on the Mott metal-insulator transition (MIT) in perovskite systems with d^1 and d^2 electron configuration of the transition metal (TM) cation. We first discuss the general trends expected from…

强关联电子 · 物理学 2016-12-14 Gabriele Sclauzero , Krzysztof Dymkowski , Claude Ederer

Using inelastic neutron scattering we measured the microscopic magnetic coupling associated with the ferromagnetic (FM) clusters of the ``colossal magnetoresistance'' (CMR) compound Pr$_{0.70}$Ca$_{0.30}$MnO$_3$. When the insulating to…

The structural, electrical transport and magnetic properties of perovskite oxides La1-xTexMnO3 have been investigated and thus the magnetic phase diagram of La1-xTexMnO3 compounds as a function of temperature and the doping level x has been…

强关联电子 · 物理学 2007-05-23 J. Yang , W. H. Song , Y. Q. Ma , R. L. Zhang , B. C. Zhao , Z. G. Sheng , G. H. Zheng , J. M. Dai , Y. P. Sun
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