Compression of a magnetic material leads to a change in its magnetic properties. We examine this effect using spin-lattice dynamics for the special case of bcc-Fe, using both …
The hexagonal Eu MX (M= Cu, Ag, Au; X= P, As, Sb, Bi) compounds host interesting electronic and magnetic properties, with seemingly intertwined topology and transport …
We present the development of machine-learning interatomic potentials for uranium dioxide UO 2. Density functional theory calculations with a Hubbard U correction were leveraged to …
Magnetoelastic interactions couple the motion of atoms in a magnetic material with atomic magnetic moments, allowing to transfer mechanical and thermal energies between phonon …