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This work is devoted to the analysis of orbital patterns and related to them interatomic magnetic interactions in centrosymmetric monoclinic structures of BiMnO$_3$, which have been recently determined experimentally. First, we set up an…

Materials Science · Physics 2008-07-11 I. V. Solovyev , Z. V. Pchelkina

Closed shell molecular structures are under normal conditions time-reversal invariant. Experimental evidences point, however, towards that this invariance may be locally violated when the structure is in contact with a particle reservoir.…

Mesoscale and Nanoscale Physics · Physics 2023-12-27 M. Shiranzaei , S. Kalhöfer , J. Fransson

The intrinsic geometric degree of freedom that was proposed to determine the optimal correlation energy of the fractional quantum Hall states, is analyzed for quantum confined planar electron systems. One major advantage in this case is…

Mesoscale and Nanoscale Physics · Physics 2014-03-27 Areg Ghazaryan , Tapash Chakraborty

This chapter takes a microscopic view of quantum tunneling of magnetization (QTM) in single-molecule magnets (SMMs), focusing on the interplay between exchange and anisotropy. Careful consideration is given to the relationship between…

Mesoscale and Nanoscale Physics · Physics 2013-03-04 Junjie Liu , Enrique del Barco , Stephen Hill

We study the magnetic structure of the ground state of an itinerant Fermi system of spin-\nicefrac{1}{2} particles with magnetic dipole-dipole interactions. We show that, quite generally, the spin state of particles depend on its momentum,…

Quantum Gases · Physics 2010-07-02 Benjamin M. Fregoso , Eduardo Fradkin

Using density functional theory, we study the magnetic stability of the Ga$_{1-x}$Mn$_x$N alloy system. We show that unlike Ga$_{1-x}$Mn$_x$As, which shows only ferromagnetic (FM) phase, Ga$_{1-x}$Mn$_x$N can be stable in either FM or…

Materials Science · Physics 2015-06-25 Gustavo M. Dalpian , Su-Huai Wei

After two decades from the discovery of ferromagnetism in Mn-doped GaAs, its origin is still debated, and many doubts are related to the electronic structure. Here we report an experimental and theoretical study of the valence electron…

Strongly Correlated Electrons · Physics 2014-07-29 I. Di Marco , P. Thunström , M. I. Katsnelson , J. Sadowski , K. Karlsson , S. Lebègue , J. Kanski , O. Eriksson

We use symmetry analysis and density functional theory to characterize antiferromagnetic (AFM) materials which have a finite equilibrium magnetization density on particular surface terminations. A nonzero magnetic dipole moment per unit…

Materials Science · Physics 2025-06-10 Sophie F. Weber , Andrea Urru , Sayantika Bhowal , Claude Ederer , Nicola A. Spaldin

We perform a theoretical study, using {\it ab initio} total energy density-functional calculations, of the effects of disorder on the $Mn-Mn$ exchange interactions for $Ga_{1-x}Mn_xAs$ diluted semiconductors. For a 128 atoms supercell, we…

Materials Science · Physics 2009-11-11 Antonio J. R. da Silva , A. Fazzio , Raimundo R. dos Santos , Luiz E. Oliveira

In recent decades, novel magnetism of $d$- and $f$-electron compounds has been discussed very intensively both in experimental and theoretical research fields of condensed matter physics. It has been recognized that those material groups…

Strongly Correlated Electrons · Physics 2009-11-11 Takashi Hotta

Dynamics of the magnetization in ferromagnets is examined in the presence of transport electrons allowing the latter to interact. It is found that the existence of inhomogeneities such as domain wall (DW) structures, leads to changes that…

Strongly Correlated Electrons · Physics 2009-11-13 Paulo F. Farinas

Electronic structure and electron correlations of the Hubbard model on the Beta-Mn lattice have been investigated on the basis of the momentum dependent local ansatz wavefunction method. It is found that the electrons on the Beta-Mn lattice…

Strongly Correlated Electrons · Physics 2022-02-09 Yoshiro Kakehashi

The ground states of few electrons confined in two vertically coupled quantum rings in the presence of an external magnetic field are studied systematically within the current spin-density functional theory. Electron-electron interactions…

Mesoscale and Nanoscale Physics · Physics 2009-10-05 L. K. Castelano , G. -Q. Hai , B. Partoens , F. M. Peeters

Using ab initio dynamical mean-field theory we explore the electronic and magnetic states of layered Li$_x$MnO$_2$ as a function of $x$, the state of charge. Constructing real-space Wannier projections of Kohn-Sham orbitals based on the…

Strongly Correlated Electrons · Physics 2023-10-18 Hrishit Banerjee , Clare P. Grey , Andrew J. Morris

Stabilization of unusual spin-orbit driven magnetic orderings are achieved for chains of Mn atoms deposited on a W(110) substrate. First-principles electronic structure calculations show that the ground state spin configuration is…

Chemical affinities are responsible for driving active matter systems out of equilibrium. At the nano-scale, molecular machines interact with the surrounding environment and are subjected to external forces. The mechano-chemical coupling…

Soft Condensed Matter · Physics 2025-01-03 Michalis Chatzittofi , Jaime Agudo-Canalejo , Ramin Golestanian

We report elastic and inelastic neutron scattering measurements of the high-TC ferromagnet Mn(1+delta)Sb. Measurements were performed on a large, TC=434 K, single crystal with interstitial Mn content of delta~0.13. The neutron diffraction…

The stable magnetisation configurations of antiferromagnets on quasiperiodic tilings are investigated theoretically. The exchange coupling is assumed to decrease exponentially with the distance between magnetic moments. It is demonstrated…

Disordered Systems and Neural Networks · Physics 2007-05-23 E. Y. Vedmedenko , U. Grimm , R. Wiesendanger

Based on Monte-Carlo simulations, the stable magnetization configurations of an antiferromagnet on a quasiperiodic tiling are derived theoretically. The exchange coupling is assumed to decrease exponentially with the distance between…

Disordered Systems and Neural Networks · Physics 2007-05-23 E. Y. Vedmedenko , U. Grimm , R. Wiesendanger

The properties of nuclear matter in the presence of a strong magnetic field, including the density-dependent symmetry energy, the chemical composition and spin polarizations, are investigated in the framework of the relativistic mean field…

Nuclear Theory · Physics 2013-01-18 Jianmin Dong , Umberto Lombardo , Wei Zuo , Hongfei Zhang
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