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To characterize the possible magnetic structures created on magnetic multilayers a model has been formulated and studied. The interlayer inhomogeneous structures found indicate either (i) a regular periodic, (ii) a quasiperiodic change in…

Materials Science · Physics 2009-10-31 F. V. Kusmartsev , H. S. Dhillon , M. D. Crapper

In this work, we present an analysis of magnetic properties of weak ferrimagnets of the YFe$_{1-x}$Cr$_x$O$_3$ type. Taking into account the main spin interactions - isotropic Heisenberg superexchange, antisymmetric Dzyaloshinskii-Moriya…

Strongly Correlated Electrons · Physics 2024-12-24 E. V. Vasinovich , A. S. Moskvin

Lacunar spinels with a chemical formula of $AM_4X_8$ form a populous family of narrow-gap semiconductors, which offer a fertile ground to explore correlation and quantum phenomena, including transition between Mott and spin-orbit insulator…

Strongly Correlated Electrons · Physics 2022-05-25 K. Geirhos , S. Reschke , S. Ghara , S. Krohns , P. Lunkenheimer , I. Kézsmárki

Oxide heterointerfaces constitute a rich platform for realizing novel functionalities in condensed matter. A key aspect is the strong link between structural and electronic properties, which can be modified by interfacing materials with…

Materials Science · Physics 2021-07-09 T. C. van Thiel , J. Fowlie , C. Autieri , N. Manca , M. Šiškins , D. Afanasiev , S. Gariglio , A. D. Caviglia

The magnetic properties of (Ca,Sr)RuO_3 and Sr_2YRuO_6 are studied within the context of band structure based Stoner theory. LSDA calculations without recourse to strong correlation effects yield the correct magnetic behavior and order in…

Materials Science · Physics 2009-10-30 I. I. Mazin , D. J. Singh

We report on optical studies of the thin films of multiferroic hexagonal (P.G. 6mm) rare-earth orthoferrites RFeO3 (R=Ho, Er, Lu) grown epitaxially on a (111)-surface of ZrO2(Y2O3) substrate. The optical absorption study in the range of…

Materials Science · Physics 2012-07-18 V. V. Pavlov , A. R. Akbashev , A. M. Kalashnikova , V. A. Rusakov , A. R. Kaul , M. Bayer , R. V. Pisarev

Double perovskites R2NiMnO6 (R= Rare earth element) (RNMO) are a significant class of materials owing to their varied tunability of the magnetic and electrical properties with the structural modifications. Pr2NiMnO6 (PNMO) is one of the…

Materials Science · Physics 2021-08-31 P. Maneesha , E. G Rini , B. Suresh , Somaditya Sen

We use ab initio electronic structure calculations within the generalized gradient approximation (GGA+U) to density functional theory (DFT) to determine the microscopic exchange interactions in the series of orthorhombic rare-earth…

Materials Science · Physics 2015-04-22 Natalya S. Fedorova , Claude Ederer , Nicola A. Spaldin , Andrea Scaramucci

Halide perovskites have emerged as one of the most interesting materials for optoelectronic applications due to their favorable properties, such as defect-tolerance and long charge carrier lifetimes, which are attributed to their dynamic…

Materials Science · Physics 2023-11-20 Julia Wiktor , Erik Fransson , Dominik Kubicki , Paul Erhart

The octahedron tilt transitions of ABX_3 perovskite-structure materials lead to an anti-polar (or antiferroelectric) arrangement of dipoles, with the low temperature structure having six sublattices polarized along various crystallographic…

Strongly Correlated Electrons · Physics 2013-05-29 Philip B. Allen , Yiing-Rei Chen , Santanu Chaudhuri , Clare P. Grey

A detailed analysis of the crystal structure in RETiO3 with RE = La, Nd, Sm, Gd, and Y reveals an intrinsic coupling between orbital degrees of freedom and the lattice which cannot be fully attributed to the structural deformation arising…

Strongly Correlated Electrons · Physics 2009-09-29 A. C. Komarek , H. Roth , M. Cwik , W. -D. Stein , J. Baier , M. Kriener , F. Bouree , T. Lorenz , M. Braden

We report investigations of the structural, magnetic, electrical transport and thermal properties of five compositions of the metallic perovskite GdRh$_3$C$_{1-x}$B$_x$ ($0.00 \le x \le 1.00$). Our results show that all the five…

Strongly Correlated Electrons · Physics 2020-09-09 Abhishek Pandey , A. K. Singh , Shovan Dan , K. Ghosh , I. Das , S. Tripathi , U. Kumar , R. Ranganathan , D. C. Johnston , Chandan Mazumdar

The aim of this work is to unravel a basic microscopic picture behind complex magnetic properties of hexagonal manganites. For these purposes, we consider two characteristic compounds: YMnO3 and LuMnO3, which form different magnetic…

Materials Science · Physics 2012-08-10 I. V. Solovyev , M. V. Valentyuk , V. V. Mazurenko

Ferrites, magnetic materials primarily composed of iron oxides, exhibit diverse magnetic behaviors, including diamagnetism, paramagnetism, ferromagnetism, antiferromagnetism, ferrimagnetism, and superparamagnetism. This paper explores the…

Materials Science · Physics 2024-06-18 Maryam M. Ahmed , Nagwa Abu-Elsaad

The magnetic, thermodynamic, and pyroelectric properties of LiFeP$_2$O$_7$ single crystals are investigated with emphasis on the magnetoelectric interaction of the electrical polarization with the magnetic order parameter. The magnetic…

Strongly Correlated Electrons · Physics 2012-09-13 K. -C. Liang , W. Zhang , B. Lorenz , Y. Y. Sun , P. S. Halasyamani , C. W. Chu

The crystal structures of the Sr1-xCaxRuO3 perovskites are investigated using both long range and local structural probes. High resolution synchrotron powder X-ray diffraction characterization at ambient temperature shows that the materials…

Materials Science · Physics 2020-03-25 Loi T. Nguyen , Milinda Abeykoon , Jing Tao , Saul Lapidus , R. J. Cava

In this work we study the interplay between the crystal structure and magnetism of the pyroarsenate \alpha-Cu_2As_2O_7 by means of magnetization, heat capacity, electron spin resonance and nuclear magnetic resonance measurements as well as…

Cation displacements, oxygen octahedral tilts, and magnetism of epitaxial, ferrimagnetic, insulating GdTiO3 films sandwiched between cubic SrTiO3 layers are studied using scanning transmission electron microscopy and magnetization…

Strongly Correlated Electrons · Physics 2013-11-05 Jack Y. Zhang , Clayton A. Jackson , Santosh Raghavan , Jinwoo Hwang , Susanne Stemmer

First-principles calculations are presented for the layered perovskite Ca$_3$Mn$_2$O$_7$. The results reveal a rich set of coupled structural, magnetic and polar domains in which oxygen octahedron rotations induce ferroelectricity,…

Materials Science · Physics 2010-12-21 Nicole A. Benedek , Craig J. Fennie

We use ab initio electronic structure calculations in combination with Monte Carlo simulations to investigate the magnetic and ferroelectric properties of bulk orthorhombic HoMnO$_3$ and ErMnO$_3$. Our goals are to explain the…

Materials Science · Physics 2018-12-12 Natalya S. Fedorova , Amadé Bortis , Christoph Findler , Nicola A. Spaldin