Atomic structure and large magnetic anisotropy in air-sensitive layered ferromagnetic VI3

Abstract

We report the air-sensitivity, atomic structure, and magnetic anisotropy of VI₃ single crystals. We find that VI₃ nanocrystals exhibit a large M_R/M_S ratio of around 0.75 and a uniaxial anisotropic constant of an order of 10⁵ erg cc⁻¹ below the Curie temperature. Furthermore, density functional theory calculations reveal that both the monolayer and bulk VI₃ are ferromagnetic insulators, and the magnetic moment of the system arises mainly from the d orbital of the V atom. These findings open a feasible avenue to fabricating TEM specimens of air-sensitive layered materials, providing an in-depth comprehensive understanding of a layered ferromagnetic VI₃.