相关论文: Spin Spirals in Surface Alloys on Ru(0001): A Firs…

Using spin-polarized scanning tunneling microscopy and density functional theory, we have studied the magnetic properties of Pd/Fe atomic bilayers on Re(0001). Two kinds of magnetic ground states are discovered due to different types of…

We present a comprehensive investigation of the influence of Ru concentration on the lattice parameters, atomic magnetic moments, electronic structure, and magnetic anisotropy energy of the full Heusler L2$_1$-type Mn$_2$Ru$_{1-x_p}$Ga…

In this paper, we use the first-principles calculations based on the density functional theory to investigate structural, electronic and magnetic properties of Fe$_{2}$YSn with (Y = Mn, Ti and V). The generalized gradient approximation…

Anisotropic exchange couplings, such as the Dzyaloshinskii-Moriya interaction (DMI), have played a vital role in the formation and dynamics of spin textures. This work predicts an anisotropic conduction electron spin density in metals with…

The collective behavior of spins in a dilute magnetic semiconductor is determined by their mutual interactions and influenced by the underlying crystal structure. Hence, we begin with the atomic quantum-mechanical description of this system…

We determined the parameters of a classical spin Hamiltonian describing an Fe monolayer on Pd(111) surface with a Pt_{1-x}Ir_{x} alloy overlayer from ab initio calculations. While the ground state of the system is ferromagnetic for x=0.00,…

Motivated by a recent experimental observation of a complex magnetic structure [Takada et al. 2013 J. Magn. Magn. Mater. 329 95] we present a theoretical study of the magnetic structure of an Fe monolayer deposited on Rh(001). We use a…

Magnetocrystalline anisotropy in transition metal alloys (FePt, CoPt, FePd, MnAl, MnGa, and FeCo) was studied using first-principles calculations to elucidate its specific mechanism. The tight-binding linear muffin-tin orbital method in the…

Correlation between dielectric and magnetic properties was investigated on the triangular lattice antiferromagnets ACrO2 (A= Cu, Ag, Li, or Na) showing 120-degree spiral spin structure with easy-axis anisotropy. For the A= Cu and Ag…

Open-shell nanographenes have attracted significant attention due to their structurally tunable spin ground state. While most characterization has been conducted on weakly-interacting substrates such as noble metals, the influence of…

We have used density functional theory to study the structural stability of surface alloys. Our systems consist of a single pseudomorphic layer of $M_xN_{1-x}$ on the Ru(0001) surface, where $M$ = Fe or Co, and $N$ = Pt, Au, Ag, Cd, or Pb.…

Antisymmetric Dzyaloshinskii-Moriya (DM) interactions generating from the spin-orbit coupling induce various fascinating properties, like magnetoelectric (ME) effect, weak ferromagnetism and non-trivial topological spin textures like…

Controlling magnetic anisotropy is a key requirement for the fundamental understanding of molecular magnetism and is a prerequisite for numerous applications in magnetic storage, spintronics, and all-spin logic devices. In order to address…

The magnetic free energy is usually quadratic in magnetic field and depends on the mutual orientation of the magnetic field and the crystalline axes. Tiny in magnitude, this magnetocrystalline anisotropy energy (MAE) is nevertheless…

We show that an individual adatom on a magnetic surface can exhibit a noncollinear spin density. Using density functional theory we study Co and Ir adatoms on a Mn monolayer on the W(110) surface which possesses a noncollinear canted spin…

Ruthenium dioxide (RuO2) has recently emerged as a candidate altermagnet, yet its intrinsic magnetic ground state, particularly in thin films, remains debated. This study aims to clarify the nature and spatial extent of the magnetic order…

We observe metastable localized spin configurations with topological charges ranging from $Q=-3$ to $Q=2$ in a (Pt$_{0.95}$Ir$_{0.05}$)/Fe bilayer on Pd$(111)$ surface by performing spin dynamics simulations, using a classical Hamiltonian…

Dzyaloshinskii-Moriya interaction, DMI in short, represents an antisymmetric type of magnetic interactions that favour orthogonal orientation of spins and competes with Heisenberg exchange. Being introduced to explain weak ferromagnetism in…

The olivine compound Mn2GeO4 is shown to feature both a ferroelectric polarization and a ferromagnetic magnetization that are directly coupled and point along the same direction. We show that a spin spiral generates ferroelectricity (FE),…

Anisotropic spin-spin interactions of Dzyaloshinsky and Moriya symmetry are generally considered weak, as they depend on the spin-orbit couplings. In spin systems with gapped ground states they can, however, have rather strong effects. We…