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We report the observation of a magnetic polarization of the O\,$2p$-states in YMn$_2$O$_5$ through the use of soft X-ray resonant scattering at the oxygen $K$-edge. Remarkably, we find that the temperature dependence of the integrated…

Strongly Correlated Electrons · Physics 2015-03-19 S. Partzsch , S. B. Wilkins , J. P. Hill , E. Schierle , E. Weschke , D. Souptel , B. Büchner , J. Geck

The influence of disorder and interaction on the ground state polarization of the two-dimensional (2D) correlated electron gas is studied by numerical investigations of unrestricted Hartree-Fock equations. The ferromagnetic ground state is…

Strongly Correlated Electrons · Physics 2009-11-10 M. Nita , V. Dinu , A. Aldea , B. Tanatar

We consider a multiferroic chain with a linear magnetoelectric coupling induced by the electrostatic screening at the ferroelectric/ferromagnet interface. We study theoretically the dynamic ferroelectric and magnetic response to external…

Materials Science · Physics 2010-08-03 A. Sukhov , C. Jia , P. P. Horley , J. Berakdar

The electronic and magnetic properties of TbMnO3 leading to its ferroelectric (FE) polarization were investigated on the basis of relativistic density functional theory (DFT) calculations. In agreement with experiment, we show that the…

Materials Science · Physics 2008-07-18 H. J. Xiang , Su-Huai Wei , M. -H. Whangbo , Juarez L. F. Da Silva

Nonequilibrium electronic transport through a quantum dot coupled to ferromagnetic leads (electrodes) is studied theoretically by the nonequilibrium Green function technique. The system is described by the Anderson model with arbitrary…

Mesoscale and Nanoscale Physics · Physics 2009-11-11 R. Swirkowicz , M. Wilczynski , J. Barnas

Magnetic nanostructures on non-magnetic or magnetic substrates have attracted strong attention due to the development of new experimental methods with atomic resolution. Motivated by this progress we have extended the full-potential…

Materials Science · Physics 2016-08-31 S. Lounis , Ph. Mavropoulos , P. H. Dederichs , S. Blügel

A first principles approach for spin and angle resolved resonant photoemission is developed within multiple scattering theory and applied to a Cr(110) surface at the 2$p$-3$d$ resonance. The resonant photocurrent from this non ferromagnetic…

Strongly Correlated Electrons · Physics 2015-06-15 F. Da Pieve , P. Krüger

The reorientation of the magnetization of a ferromagnetic monolayer is calculated with the help of many-body Green's function theory. This allows, in contrast to other spin wave theories, a satisfactory calculation of magnetic properties…

Strongly Correlated Electrons · Physics 2015-06-25 P. Fröbrich , P. J. Jensen , P. J. Kuntz

Multiferroic materials, in which electric polarization and magnetic order coexist and couple, offer rich opportunities for both fundamental discovery and technology. However, multiferroicity remains rare due to conflicting electronic…

Materials Science · Physics 2025-10-14 Y. Sun , Y. Ahn , D. Sapkota , H. S. Arachchige , R. Xue , S. Mozaffari , D. G. Mandrus , L. Zhao , J. Orenstein , V. Sunko

The occurrence of a finite mismatch between the up and down spin energy channels due to the application of an electric field, leading to the generation of a polarized spin current from an unpolarized beam in antiferromagnetic materials, has…

Mesoscale and Nanoscale Physics · Physics 2025-11-19 Suparna Sarkar , Santanu K. Maiti

We present electronic structure calculations in combination with local and non-local many-body correlation effects for the half-metallic ferromagnet CrO$_2$. Finite-temperature Dynamical Mean Field Theory results show the existence of…

Strongly Correlated Electrons · Physics 2014-04-15 L. Chioncel , H. Allmaier , E. Arrigoni , A. Yamasaki , M. Daghofer , M. I. Katsnelson , A. I. Lichtenstein

We develop a method for the calculation of ballistic transport from first principles. The multiple scattering screened Korringa-Kohn-Rostoker (KKR) method is combined with a Green's function formulation of the Landauer approach for the…

Materials Science · Physics 2009-11-10 Ph. Mavropoulos , N. Papanikolaou , P. H. Dederichs

Frustrated triangular molecular magnets (MMs) with anti-ferromagnetic ground states (GS) are an important class of magnetic systems with potential applications in quantum information processing. The two-fold degenerate GS of these…

Mesoscale and Nanoscale Physics · Physics 2025-01-20 M. F. Islam , Kushantha P. K. Withanage , C. M. Canali , Mark R. Pederson

The ground-state structural and electronic properties of ferroelectric BiFeO$_3$ are calculated using density functional theory within the local spin-density approximation and the LSDA+U method. The crystal structure is computed to be…

Materials Science · Physics 2007-05-23 J. B. Neaton , C. Ederer , U. V. Waghmare , N. A. Spaldin , K. M. Rabe

We present an exact, analytic solution of the spin dependent quantum transport problem with spin-orbit interaction in a one-dimensional mesoscopic ring with one input and two output leads. We demonstrate that for appropriate parameters…

Quantum Physics · Physics 2008-01-24 Orsolya Kalman , Peter Foldi , Mihaly G. Benedict , F. M. Peeters

We address a systematic microscopic theory of spin-dependent electric polarization in 3d oxides starting with a generic three-site two-hole cluster. A perturbation scheme realistic for 3d oxides is applied which implies the quenching of…

Strongly Correlated Electrons · Physics 2009-11-13 A. S. Moskvin , S. -L. Drechsler

Spin-driven multiferroics exhibit strong magnetoelectric coupling, with notable polarization changes under a magnetic field, but these effects are usually limited to high-Z magnetic insulators with low electronic polarization. In this work,…

Materials Science · Physics 2024-12-31 Ranquan Cao , Ruizhi Dong , Ruixiang Fei , Yugui Yao

We have investigated the variation of induced ferroelectric polarization under magnetic field with various directions and magnitudes in a staggered antiferromagnet Ba$_2$CoGe$_2$O$_7$. While the ferroelectric polarization cannot be…

Strongly Correlated Electrons · Physics 2015-05-19 H. Murakawa , Y. Onose , S. Miyahara , N. Furukawa , Y. Tokura

Electrical injection in organic semiconductors is a key prerequisite for the realization of organic spintronics. Using density-functional theory calculations we report the effect of electron transfer into the organic molecule Alq$_3$. Our…

Materials Science · Physics 2015-05-19 Kartick Tarafder , Biplab Sanyal , Peter M. Oppeneer

We investigate electric polarizations emergent perpendicular to an applied thermal gradient in insulating systems. The thermally-induced electric polarization, known as thermopolarization, has been studied conventionally in the case that an…

Strongly Correlated Electrons · Physics 2022-06-29 Joji Nasu , Satoru Hayami