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In 5d transition metal oxides, novel properties arise from the interplay of electron correlations and spin--orbit interactions. Na4IrO4, where 5d transition-metal Ir atom occupies the center of the square-planar coordination environment, is…

Materials Science · Physics 2017-12-01 Di Wang , Feng Tang , Yongping Du , Xiangang Wan

An extensive {\it ab initio} study of the physical properties of both linear and zigzag atomic chains of all 4$d$ and 5$d$ transition metals (TM) within the GGA by using the accurate PAW method, has been carried out. All the TM linear…

Mesoscale and Nanoscale Physics · Physics 2015-05-18 J. C. Tung , G. Y. Guo

We report measurements of the electron transport through atomic-scale constrictions and tunnel junctions between ferromagnetic electrodes. Structures are fabricated using a combination of e-beam lithography and controlled electromigration.…

Mesoscale and Nanoscale Physics · Physics 2007-05-23 Z. K. Keane , L. H. Yu , D. Natelson

Using density functional theory calculations, we demonstrate that the effect of anisotropic magnetoresistance (AMR) can be enhanced by orders of magnitude with respect to conventional bulk ferromagnets in junctions containing molecules…

Mesoscale and Nanoscale Physics · Physics 2015-12-23 Fabian Otte , Stefan Heinze , Yuriy Mokrousov

Magneto-resistance is a physical effect of great fundamental and industrial interest since it is the basis for the magnetic field sensors used in computer read-heads and Magnetic Random Access Memories. As device dimensions are reduced,…

Mesoscale and Nanoscale Physics · Physics 2009-11-11 M. Viret , M. Gabureac , F. Ott , C. Fermon , C. Barreteau , R. Guirado-Lopez

First-principles calculations are used to gauge different levels of approximation to calculate the magnetocrystalline anisotropy energies (MAE) of five $L1_0$ FeMe alloys (Me=Co, Cu, Pd, Pt, Au). We find that a second-order perturbation…

Materials Science · Physics 2020-12-14 M. Blanco-Rey , J. I. Cerda , A. Arnau

We calculate magnetic anisotropy energy of Fe and Ni by taking into account the effects of strong electronic correlations, spin-orbit coupling, and non-collinearity of intra-atomic magnetization. The LDA+U method is used and its equivalence…

Strongly Correlated Electrons · Physics 2009-10-31 Imseok Yang , Sergej Y. Savrasov , Gabriel Kotliar

Substantial amounts of the transition metals Mn, Fe, Co, and Ni can be substituted for Li in single crystalline Li$_2$(Li$_{1-x}T_x$)N. Isothermal and temperature-dependent magnetization measurements reveal local magnetic moments with…

Materials Science · Physics 2015-06-09 A. Jesche , L. Ke , J. L. Jacobs , B. Harmon , R. S. Houk , P. C. Canfield

The magnetic properties of iron (spin and orbital magnetic moments, magnetocrystalline anisotropy energy) in various geometries and dimensionalities are investigated by using a parametrized tight-binding model in an $s$, $p$ and $d$ atomic…

Materials Science · Physics 2008-04-22 Gabriel Autes , Cyrille Barreteau , Daniel Spanjaard , Marie-Catherine Desjonqueres

We calculate magnetic anisotropy energy of Fe and Ni by taking into account the effects of strong electronic correlations, spin-orbit coupling, and non-collinearity of intra-atomic magnetization. The LDA+U method is used and its equivalence…

Materials Science · Physics 2007-05-23 I. Yang , S. Y. Savrasov , G. Kotliar

We study here, both experimentally and theoretically, the anisotropy of magnetoresistance in atomic contacts. Our measurements on iron break junctions reveal an abrupt and hysteretic switch between two conductance levels when a large…

Other Condensed Matter · Physics 2009-11-13 Gabriel Autes , Cyrille Barreteau , Marie-Catherine Desjonquères , Daniel Spanjaard , Michel Viret

One-dimensional metal-organic chains often possess a complex magnetic structure susceptible to be modified by a alteration of their chemical composition. The possibility to tune their magnetic properties provides an interesting playground…

We calculate magnetic anisotropy energy of Fe and Ni by taking into account the effects of strong electronic correlations, spin-orbit coupling, and non-collinearity of intra--atomic magnetization. The LDA+U method is used and its…

Strongly Correlated Electrons · Physics 2007-05-23 Imseok Yang , Sergej Y. Savrasov , Gabriel Kotliar

The appearance of intrinsic ferromagnetism in 2D materials opens the possibility of investigating the interplay between magnetism and topology. The magnetic anisotropy energy (MAE) describing the easy axis for magnetization in a particular…

Single molecule magnets (SMMs) with single-ion anisotropies $\mathbf d$, comparable to exchange interactions J, between spins have recently been synthesized. In this paper, we provide theoretical insights into the magnetism of such systems.…

Strongly Correlated Electrons · Physics 2017-11-22 Sumit Haldar , Rajamani Raghunathan , Jean-Pascal Sutter , S. Ramasesha

The new challenges posed by the need of finding strong rare-earth free magnets demand methods that can predict magnetization and magnetocrystalline anisotropy energy (MAE). We argue that correlated electron effects, which are normally…

The capacity to externally manipulate magnetic properties is highly desired from both fundamental and technological perspectives, particularly in the development of magnetoelectronics and spintronics devices. Here, using first-principles…

Materials Science · Physics 2024-02-27 Rui-Qi Wang , Tian-Min Lei , Yue-Wen Fang

Magneto-active elastomers (MAEs) are composite materials comprising an elastomer matrix with embedded magnetic particles, endowing the composite with coupled effective magneto-mechanical responses. It is widely reported that anisotropic…

Materials Science · Physics 2025-04-17 Connor D. Pierce , Kathryn H. Matlack

The magnetoresistance (MR) effect in metallic atomic-sized contacts is studied theoretically by means of first-principle electronic structure calculations. We consider three-atom chains formed from Co, Cu, Si, and Al atoms suspended between…

Materials Science · Physics 2007-05-23 Alexei Bagrets , Nikos Papanikolaou , Ingrid Mertig

Recent ab intio studies of the magnetic properties of all 3d transition metal(TM) freestanding atomic chains predicted that these nanowires could have a giant magnetic anisotropy energy (MAE) and might support a spin-spiral structure,…

Mesoscale and Nanoscale Physics · Physics 2015-05-27 J. C. Tung , Y. K. Wang , G. Y. Guo
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