This review addresses the method of explicit calculations of interatomic exchange
interactions of magnetic materials. This involves exchange mechanisms normally referred to …

A material's magnetic state and its dynamics are of great fundamental research interest and
are also at the core of a wide plethora of modern technologies. However, reliable access to …

Using relativistic first-principles calculations, we show that the chemical trend of the
Dzyaloshinskii-Moriya interaction (DMI) in 3 d-5 d ultrathin films follows Hund's first rule with …

In this work, we present theoretical predictions of a two-dimensional collinear
antiferromagnetic semimetal, CrO, which exhibits a giant spin-split band structure, spin …

A parallel implementation of coupled spin–lattice dynamics in the LAMMPS molecular
dynamics package is presented. The approach is very general, and can be applied to simple …

Few-layer CrI 3 is the most known example among two-dimensional (2D) ferromagnets,
which have attracted growing interest in recent years. Despite considerable efforts and …

Dynamical Mean-Field Theory (DMFT) has opened new perspectives for the investigation of
strongly correlated electron systems and greatly improved our understanding of correlation …

The Dzyaloshinskii-Moriya interaction (DMI) is an antisymmetric exchange interaction, which
is responsible for the formation of topologically protected spin textures in chiral magnets …

Magnetic skyrmions are prime candidates for the next generation of spintronic devices.
Skyrmions and other topological magnetic structures are known to be stabilized by the …

The Dzyaloshinskii-Moriya (DM) interaction, as well as symmetric anisotropic exchange, are
important ingredients for stabilizing topologically nontrivial magnetic textures, such as, eg …