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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…
The compound MnAu$_2$ is one of the oldest known spin-spiral materials, yet the nature of the spiral state is still not clear. The spiral cannot be explained via relativistic effects due to the short pitch of the spiral and the weakness of…
We present a detailed first principles study on the magnetic structure of an Fe monolayer on different surfaces of 5d transition metals. We use the spin-cluster expansion technique to obtain parameters of a spin model, and predict the…
The magnetic structure of a Cr monolayer on a W(110) substrate is investigated by means of first-principles calculations based on the noncollinear spin density functional theory (DFT). As magnetic ground state we find a long-period…
Ultrathin magnetic films on heavy metal substrates with strong spin-orbit coupling provide versatile platforms for exploring novel spin textures. So far, structurally open fcc(110) substrates remain largely terra incognita. Here, we…
Based on the Korringa-Kohn-Rostoker Green's function technique we present a computational scheme for calculating the electronic structure of layered systems with homogeneous spin-spiral magnetic state. From the self-consistent…
We report on experimental verification of the rotational sense and type of homogeneous chiral spin spiral order in a Mn monolayer on a W(110) substrate using spin-polarized scanning tunneling microscopy. We found that the magnetic contrast…
A scheme to calculate the electronic structure of systems having a spiral magnetic structure is presented. The approach is based on the KKR (Korringa-Kohn-Rostoker) Green's function formalism which allows in combination with CPA (Coherent…
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,…
We determine experimentally the spin structure of half-metallic Co2FeAl0.4Si0.6 Heusler alloy elements using magnetic microscopy. Following magnetic saturation, the dominant magnetic states consist of quasi-uniform configurations, where a…
We investigate the interplay between the structural reconstruction and the magnetic properties of Fe doublelayers on Ir (111)-substrate using first-principles calculations based on density functional theory and mapping of the total energies…
We present a detailed theoretical investigation on the magnetic properties of small single-layered Fe, Co and Ni clusters deposited on Ir(111), Pt(111) and Au(111). For this a fully relativistic {\em ab-initio} scheme based on density…
The mechanism of spin reorientation in Nd$_{2}$Fe$_{14}$B, which is a host crystal of a well-known neodymium permanent magnet, is studied by combining first-principles calculations and Monte Carlo simulations. The spin reorientation is…
Anisotropic spin-spin interactions of the symmetry described by Dzyaloshinsky and Moriya are generally considered weak, as they depend on the spin-orbit couplings. In frustrated spin systems with singlet ground states they can, however,…
Using density functional theory, we investigate the interplay between the stacking order and sequence of bilayers composed of an Fe and a Rh layer on the Re(0001) and their magnetic properties. We find that fcc/ffc stacked bilayers are…
We present a detailed study of the ground-state magnetic structure of ultrathin Fe films on the surface of fcc Ir(001). We use the spin-cluster expansion technique in combination with the relativistic disordered local moment scheme to…
New neutron diffraction and inelastic scattering experiments are used to investigate in detail the field dependence of the magnetic structure and low-energy spin wave spectrum of the Dzyaloshinskii-Moriya helimagnet Ba_2 Cu Ge_2 O_7. The…
MnAu$_{2}$ is a spin-spiral material with in-plane ferromagnetic Mn layers that form a screw-type pattern around a tetragonal $c$ axis. The spiral angle $\theta$ was shown using neutron diffraction experiments to decrease with pressure, and…
The magnetic ground state of nanosized systems such as Fe double chains, recently shown to form in the early stages of Fe deposition on Ir(100), is generally nontrivial. Using ab initio density functional theory we find that the straight…
The nature of the magnetism brought about by Fe adatoms on the surface of the topological insulator Bi2Se3 was examined in terms of density functional calculations. The Fe adatoms exhibit strong easy-axis magnetic anisotropy in the dilute…