Related papers: Charge screening and magnetic anisotropy in metall…
An analysis of magnetic anisotropy in RCo5 compounds is performed with account of screening of ion point charges by conduction electrons. A crucial role of non-uniform distribution of screening electrons (the terms containing derivatives of…
The current progress in describing rare-earth-based magnets' electronic structure and magnetic properties is discussed. We use several currently popular electronic structure methods to show the typical values of critical parameters that…
Density functional theory (DFT), including its extensions designed to treat strongly correlated localized electron systems such as DFT+$U$ and DFT+dynamical mean field theory, has proven exceedingly useful in studying the magnetic…
We show that ions at the low densities and high magnetic fields relevant to the outer crust of magnetars form a novel crystalline phase where ions are strongly coupled along the magnetic field and loosely coupled in the transverse…
We calculate the screening of the ion-ion potential due to electrons in the presence of a large background magnetic field, at densities of relevance to neutron star crusts. Using the standard approach to incorporate electron screening…
Magnetic anisotropy is a key feature of rare earth materials from permanent magnets to heavy fermions. We explore the complex interplay of Kondo physics and anisotropy, and their effect on different experimental probes of magnetic…
We apply the first-principles density functional theory + dynamical mean field theory framework to evaluate the crystal field splitting on rare earth sites in hard magnetic intermetallics. An atomic (Hubbard-I) approximation is employed for…
The new challenges posed by the need of finding strong rare-earth free magnets demand methods that can predict magnetization and magnetocrystalline anisotropy energy (MAE). We argue that correlated electron effects, which are normally…
We present a theory describing the single-ion anisotropy of rare earth (RE) magnets in the presence of point defects. Taking the RE-lean 1:12 magnet class as a prototype, we use first-principles calculations to show how the introduction of…
Mapping the magnetic exchange interactions from model Hamiltonian to density functional theory is a crucial step in multi-scale modeling calculations. Considering the usual magnetic force theorem but with arbitrary rotational angles of the…
Resistivity measurements are widely exploited to uncover electronic excitations and phase transitions in metallic solids. While single crystals are preferably studied to explore crystalline anisotropies, these usually cancel out in…
Layered {\alpha}-RuCl3 is a promising material to potentially realize the long-sought Kitaev quantum spin liquid with fractionalized excitations. While evidence of this exotic state has been reported under a modest in-plane magnetic field,…
The generalized Fisher super-exchange antiferromagnetic model with uniaxial crystal-field anisotropy is exactly investigated using an extended mapping technique. An exact relation between partition function of the studied system and that…
We calculate the screening charge density distribution due to a point charge, such as that of a positive muon ($\mu^+$), placed between the planes of a highly anisotropic layered metal. In underdoped hole cuprates the screening charge…
We investigate the effects of an applied magnetic field on the magnetic properties of the antiferromagnet GdCoIn$_5$. The prominent anisotropy observed in the susceptibility below $T_N$ is rapidly suppressed by a field of just a few Tesla.…
Density functional theory (DFT) has long struggled to treat light rare-earth magnetism. We show that this difficulty arises from an overestimate of the $4f$ charge asphericity, and thus the magnetic anisotropy energy, due to the inadequacy…
We examine the anisotropic properties of the exchange stiffness constant, $\mathcal{A}$, for rare-earth permanent magnet, Nd$_2$Fe$_{14}$B, by connecting analyses with two different scales of length, i.e., Monte Carlo (MC) method with an…
Magnetocrystalline anisotropy is a fundamental property of magnetic materials that determines the dynamics of magnetic precession, the frequency of spin waves, the thermal stability of magnetic domains, and the efficiency of spintronic…
The single ion properties of the zig-zag chain compound SrTm$_2$O$_4$ have been investigated using heat capacity, magnetic susceptibility, magnetization, inelastic neutron scattering, and polarized muon spectroscopy. Two crystal field…
The field-angular dependence and anisotropy of the critical current density in iron-based superconductors is evaluated using a phenomenological approach featuring distinct anisotropy factors for the penetration depth and the coherence…