
Using sequential STEM imaging, a larger number of jumps is observed for heavy Ce dopants, in agreement with a low activation barrier obtained by density functional theory-based calculations. The calculations attribute this low migration barrier to the size-mismatch of the large Ce atom in the smaller AlN host-lattice. In contrast calculations predicted a higher barrier and, hence, a smaller number of jumps for a smaller-size dopant like Mn. This prediction is confirmed by the STEM experiments, which show the Mn atoms to be nearly stationary in AlN. Overall, the results highlight a new methodology to investigate diffusion mechanisms in bulk materials.
R. Ishikawa, R. Mishra, A. R. Lupini, S. D. Findlay, T. Taniguchi, S. T. Pantelides, and S. J. Pennycook, “Direct observation of dopant atom diffusion in a bulk semiconductor crystal enhanced by a large size mismatch,” Phys. Rev. Lett. 113, 155501 (2014).
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