Transmission electron microscopy/electron energy loss spectroscopy measurements and ab initio calculation of local magnetic moments at nickel grain boundaries

We have determined local magnetic moments at nickel grain boundaries using a transmission electron microscopy/electron energy loss spectroscopy method assuming that the magnetic moment of Ni atoms is a linear function of the L₃/L₂ (white-line ratio) in the energy loss spectrum. The average magnetic moment measured in the grain interior was 0.55 μ_B, which agrees well with the calculated magnetic moment of pure nickel (0.62 μ_B). The local magnetic moments at the grain boundaries increased up to approximately 1.0 μ_B as the mis-orientation angle increased, and showed a maximum around 50°. The respective enhancement of local magnetic moments at the Σ5 (0.63 μ_B) and random (0.90 μ_B) grain boundaries in pure nickel was approximately 14 and 64% of the grain interior. In contrast, the average local magnetic moment at the (111) Σ3 grain boundary was found to be 0.55 μ_B and almost the same as that of the grain interior. These results are in good agreement with available ab initio calculations.