Magnetism and electronic structure of a fcc lattice
Phys. Rev. B 112, 224436 – Published 22 December, 2025
DOI: https://doi.org/10.1103/fwqd-1tr1
Abstract
Magnetic materials with three-dimensional (3D) frustrated spin networks manifest a variety of exotic quantum ground states. We investigate the magnetic and thermal properties and the electronic structure of , which has a 3D frustrated face-centered-cubic (fcc) lattice of moments. The low-temperature magnetic susceptibility confirms the state interacting antiferromagnetically with the Curie-Weiss temperature . The zero-field specific heat data reveal the absence of magnetic long-range order down to 100 mK. A significant difference in the magnetic entropy between the zero field and the applied magnetic field highlights its potential towards adiabatic demagnetization refrigeration applications. First-principles calculations reveal a combination of strong spin-orbit coupling and pronounced magnetocrystalline anisotropy. Realizing a spin-orbit-coupled system on an fcc lattice, emerges as a compelling system to study the interplay of frustration, single-ion anisotropy, and quantum magnetism in 3D lattices.