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Using first-principles calculations, we show that the magnetic properties of a two-dimensional antiferromagnetic transition-metal surface are modified on the atomic scale by the adsorption of small organic molecules. We consider benzene…

Materials Science · Physics 2015-06-16 Nuala M. Caffrey , Paolo Ferriani , Simone Marocchi , Stefan Heinze

While some of the most elegant applications of topological insulators, such as quantum anomalous Hall effect, require the preservation of Dirac surface states in the presence of time-reversal symmetry breaking, other phenomena such as…

Materials Science · Physics 2020-07-15 Slimane Laref , Sumit Ghosh , Evgeny Y. Tsymbal , Aurelien Manchon

Motivated by recent experiments, the effect of the interlayer exchange interaction $J_{inter}$ on the magnetic properties of coupled Co/Cu/Ni trilayers is studied theoretically. Here the Ni film has a lower Curie temperature $T_{C,\rm Ni}$…

Strongly Correlated Electrons · Physics 2009-10-31 P. J. Jensen , K. H. Bennemann , P. Poulopoulos , M. Farle , F. Wilhelm , K. Baberschke

Magnetic 2D materials have achieved significantly consideration owing to their encouraging applications. A variation of these 2D materials by occurrence of defects, by the transition-metal doping or adsorption or by the surface…

Materials Science · Physics 2025-06-27 Zarah Khan , Saleem Ayaz Khan , Ayesha Zaheer , Syed Rizwan

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

In order to investigate the interaction between single vacancies in a graphene sheet, we have used spin-polarized density functional theory (DFT). Two distinct configurations were considered, either with the two vacancies located in the…

Mesoscale and Nanoscale Physics · Physics 2016-06-22 Wanderla L. Scopel , Wendel S. Paz , Jair C. C. Freitas

Two-dimensional van der Waals (vdW) magnetic materials are versatile platforms for tailoring electronic and magnetic properties, in which the insertion of chemical species into their interlayer gaps offers a powerful route to engineer…

Spin polarization induced by an external electric field in graphene is considered theoretically in the linear response regime. The graphene is assumed to be deposited on a substrate which leads to the spin-orbit interaction of Rashba type.…

Mesoscale and Nanoscale Physics · Physics 2015-06-17 A. Dyrdał , J. Barnaś , V. K. Dugaev

In the quantum Hall regime of graphene, antiferromagnetic and spin-polarized ferromagnetic states at the zeroth Landau level compete, leading to a canted antiferromagnetic state depending on the direction and magnitude of an applied…

Mesoscale and Nanoscale Physics · Physics 2020-07-01 Y. Li , M. Amado , T. Hyart , G. P. Mazur , V. Risinggård , T. Wagner , L. McKenzie Sell , G. Kimbell , J. Wunderlich , J. Linder , J. W. A. Robinson

It was recently observed that materials showing most striking multiferroic phenomena are frustrated spin-density-wave magnets. We present a simple phenomenological theory, which describes the orientation of the induced electric polarization…

Strongly Correlated Electrons · Physics 2009-11-11 Maxim Mostovoy

We theoretically investigate magnetic anisotropy in materials with non-critical elements to determine which symmetry conditions and atomic shell filling favor enhanced magnetic anisotropy. We study the magnetocrystalline anisotropies (MCA)…

Materials Science · Physics 2025-07-08 Nica Jane B. Ferrer , Gregory A. Fiete

In order to clarify the influence of ferromagnetism on superconductivity through a normal metal layer, the superconducting properties of epitaxial Nb(110)/Au(111)/Fe(110) trilayers were studied as a function of the thickness tAu of the…

Superconductivity · Physics 2009-11-11 Hiroki Yamazaki , Nic Shannon , Hidenori Takagi

We have investigated the magnetism of the bare and graphene-covered (111) surface of a Ni single crystal employing three different magnetic imaging techniques and ab initio calculations, covering length scales from the nanometer regime up…

We report the electrochemical tuning of magnetic properties in the Na2Mn3O7 maple-leaf lattice (MLL) through ion deintercalation, revealing a switch from the 1D antiferromagnetic (AFM) spin-chain behavior of the S=3/2 MLL structure to…

We address the interaction of graphene with 3d transition metal adatoms and the formation of localized magnetic moments by means of first-principles calculations. By comparing calculations within the generalized gradient approximation (GGA)…

Strongly Correlated Electrons · Physics 2011-12-14 T. O. Wehling , A. I. Lichtenstein , M. I. Katsnelson

Using first-principles density functional theory, we investigate the interfacial magnetoelectric coupling in a tri-component superlattice composed of a ferromagnetic metal (FM), ferroelectric (FE), and normal metal (NM). Using Fe/FE/Pt as a…

Materials Science · Physics 2010-04-29 Jaekwang Lee , Na Sai , Tianyi Cai , Qian Niu , Alexander A. Demkov

Spin splitting of the energy spectrum of single-layer graphene on Au/Ni(111) substrate has been recently reported. I show that eigenstates of spin-orbit coupled graphene are polarized in-plane and perpendicular to electron momentum $\bf k$;…

Mesoscale and Nanoscale Physics · Physics 2015-05-13 Emmanuel I. Rashba

We performed susceptibility, magnetization, specific heat, and single crystal neutron diffraction measurements on single crystalline BaMn$_2$Si$_2$O$_7$. Based on the results, we revisited its spin structure with a more accurate solution…

Strongly Correlated Electrons · Physics 2019-07-31 G. H. Wang , C. Y. Xu , H. B. Cao , T. Hong , Q. Huang , Q. Y. Ren , J. Q. Xu , H. D. Zhou , W. D. Luo , D. Qian , J. Ma

The electronic and magnetic properties of neutral substitutional transition-metal dopants in dia- mond are calculated within density functional theory using the generalized gradient approximation to the exchange-correlation potential. Ti…

Materials Science · Physics 2015-06-03 Thomas Chanier , Craig Pryor , Michael E. Flatte'

We investigate magnetically-induced ferroelectricity in Cu2MnSnS4 by means of Landau theory of phase transitions and of ab initio density functional theory. As expected from the Landau approach, ab initio calculations show that a non-zero…

Materials Science · Physics 2015-05-18 Tetsuya Fukushima , Kunihiko Yamauchi , Silvia Picozzi