Article ID | Journal | Published Year | Pages | File Type |
---|---|---|---|---|
5384638 | Chemical Physics Letters | 2011 | 4 Pages |
Abstract
⺠The rapid diffusion in nanoparticles were reproduced by MD simulations. ⺠The atomistic diffusion mechanism in a metal cluster is Surface Peeling Mechanism. ⺠In contrast, the diffusion mechanism in an alkali halide cluster is Vacancy Mechanism. ⺠The vacancy formation energy of metal clusters increases as their size decreases, while that of alkali halides decreases. ⺠This opposite trend is a reason for the onset of the totally different mechanisms.
Related Topics
Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
Authors
Tomoaki Niiyama, Shin-ichi Sawada, Kensuke S. Ikeda, Yasushi Shimizu,