Universal distribution of magnetic anisotropy of impurities in ordered and disordered nano-grains

Abstract

We examine the distribution of the magnetic anisotropy (MA) experienced by a magnetic impurity embedded in a metallic nano-grain. As an example of a generic magnetic impurity with partially filled $d$-shell, we study the case of $d^{1}$ impurities imbedded into ordered and disordered Au nano-grains, described in terms of a realistic band structure. Confinement of the electrons induces a magnetic anisotropy that is large, and can be characterized by 5 real parameters, coupling to the quadrupolar moments of the spin. In ordered (spherical) nano-grains, these parameters exhibit symmetrical structures and reflect the symmetry of the underlying lattice, while for disordered grains they are randomly distributed and, - for stronger disorder, - their distribution is found to be characterized by random matrix theory. As a result, the probability of having small magnetic anisotropies $K_L$ is suppressed below a characteristic scale $Δ_E$, which we predict to scale with the number of atoms $N$ as $Δ_E\sim 1/N^{3/2}$. This gives rise to anomalies in the specific heat and the susceptibility at temperatures $T\sim Δ_E$ and produces distinct structures in the magnetic excitation spectrum of the clusters, that should be possible to detect experimentally.