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Related papers: Correlation in noncollinear antiferromagnetic $\al…

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We have studied equilibration with respect to isospin degree of freedom in four 96 mass systems $^{96}Ru+^{96}Ru$, $^{96}Ru+^{96}Zr$, $^{96}Zr+^{96}Ru$, $^{96}Zr+^{96}Zr$ at 100 AMeV and 400 AMeV with isospin dependent QMD. We propose that…

Nuclear Theory · Physics 2016-09-08 Qingfeng Li , Zhuxia Li

We investigate nonequilibrium phenomena in magnetic nano-junctions using a numerical approach that combines classical spin dynamics with the hierarchical equations of motion technique for quantum dynamics of conduction electrons. Our focus…

Mesoscale and Nanoscale Physics · Physics 2024-02-26 Rudolf Smorka , Michael Thoss , Martin Žonda

Altermagnets host an array of magnetic multipoles, which are often visualized and studied in the reciprocal space. In the real space, the relative phase of the multipoles of the spin-density around atoms determines whether a system is an…

Materials Science · Physics 2026-01-01 Luca Buiarelli , Rafael M. Fernandes , Turan Birol

We generalize the treatment of the electronic spin degrees of freedom in density functional calculations to the case where the spin vector variables employed in the definition of the energy functional can vary in any direction in space. The…

Other Condensed Matter · Physics 2007-05-23 Juan E. Peralta , Gustavo E. Scuseria , Michael J. Frisch

Density-functional calculations are carried out to investigate incommensurate magnetic structures and ferroelectric polarization in newly discovered multiferroic material MnI$_2$. The exchange interactions among local moments on Mn are…

Strongly Correlated Electrons · Physics 2013-05-30 Xianxin Wu , Yingxiang Cai , Qing Xie , Hongming Weng , Heng Fan , Jiangping Hu

We studied the electronic structure of $\beta$-uranium, which has five non-equivalent atomic sites in its unit cell, by means of the density functional theory plus Hubbard-$U$ correction. We found that the 5$f$ electronic correlations in…

Strongly Correlated Electrons · Physics 2021-04-27 Ruizhi Qiu , Liuhua Xie , Li Huang

We investigate the structural conditions for metamagnetism in MnP and related materials using Density Functional Theory. A magnetic stability plot is constructed taking into account the two shortest Mn-Mn distances. We find that a…

Materials Science · Physics 2010-06-23 Z. Gercsi , K. G. Sandeman

We use the density-functional theory to calculate the total energy of mixed crystals (Ga,Mn)As with a small concentration of various donors. We find that the formation energy of Mn depends strongly on the partial concentrations of Mn in the…

Materials Science · Physics 2007-05-23 J. Masek , I. Turek , J. Kudrnovsky , F. Maca , V. Drchal

A large body of knowledge about magnetism is attained from models of interacting spins, which usually reside on magnetic ions. Proposals beyond the ionic picture are uncommon and seldom verified by direct observations in conjunction with…

Non-collinear magnetic order arises for various reasons in several magnetic systems and exhibits interesting spin dynamics. Despite its ubiquitous presence, little is known of how magnons, otherwise stable quasiparticles, decay in these…

We present a theoretical study of the impact of an electric field combined with a magnetic field on the rotational dynamics of open shell diatomic molecules. Within the rigid rotor approximation, we solve the time-independent Schr\"odinger…

Chemical Physics · Physics 2015-06-12 Martin Gärttner , Juan J. Omiste , Peter Schmelcher , Rosario González-Férez

We present numerical experiments aimed to study the correlation between the magnetic field strength, $B$, and the density, $n$, in the cold atomic interstellar medium (CNM). We analyze 24 magneto-hydrodynamic models with different initial…

Astrophysics of Galaxies · Physics 2018-05-09 Adriana Gazol , Marco Villagran

Two-dimensional interacting electron systems become strongly correlated if the electrons are subject to a perpendicular high magnetic field. After introducing the physics of the quantum Hall regime the incompressible many- particle ground…

Mesoscale and Nanoscale Physics · Physics 2016-07-27 Marcus Kasner

We study the response of a spin glass system with respect to the rescaling of its interaction random variables and investigate numerically the behaviour of the correlation functions with respect to the volume. While for a ferromagnet the…

Disordered Systems and Neural Networks · Physics 2009-11-13 Pierluigi Contucci , Francesco Unguendoli , Cecilia Vernia

The magnetic response of strongly localized electrons to a time-dependent vector potential is considered. The orbital magnetic moment of the system, away from steady-state conditions, is obtained. The expression involves the tunneling and…

Condensed Matter · Physics 2009-10-28 Y. Galperin , O. Entin-Wohlman

Using first-principles calculations, we study the occurrence of non-collinear magnetic order in monatomic Mn chains. First, we focus on freestanding Mn chains and demonstrate that they exhibit a pronounced non-collinear ground state in a…

Mesoscale and Nanoscale Physics · Physics 2015-05-20 Franziska Schubert , Yuriy Mokrousov , Paolo Ferriani , Stefan Heinze

We study the magnetic properties of small Mn ring shaped clusters on a Pt(111) surface in the framework of density functional theory. We find that the Mn atoms possess large magnetic moments, of the order of 4uB/atom, and have dominating…

Mesoscale and Nanoscale Physics · Physics 2015-05-20 M. S. Ribeiro , G. B. Corrêa , A. Bergman , L. Nordström , O. Eriksson , A. B. Klautau

The transport properties of interacting electrons for which the spin degree of freedom is taken into account are numerically studied for small two dimensional diffusive clusters. On-site electron-electron interactions tend to delocalize the…

Mesoscale and Nanoscale Physics · Physics 2009-11-07 Richard Berkovits , Jan W. Kantelhardt

We study the composition dependent evolution of geometric and magnetic structures of MnO clusters within density functional theory. A systematic and extensive search through the potential energy surface is performed to identify the correct…

Materials Science · Physics 2018-10-16 Shreemoyee Ganguly , Mukul Kabir , Carmine Autieri , Biplab Sanyal

We present an ab initio method for eletcronic structure calculations, which accounts for the interaction of electrons and magnons in ferromagnets. While it is based on a many body perturbation theory we approximate numerically complex…

Materials Science · Physics 2023-04-19 S. Paischer , G. Vignale , M. I. Katsnelson , A. Ernst , P. Buczek