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DIFFUSION MECHANISM AT THE GRAIN BOUNDARIES IN TWO-DIMENSIONAL METALS |
Mikhail D. Starostenkov , Gennady M. Poletaev , Roman Y. Rakitin |
Altai State Technical University (ASTU), Lenin st.46, Barnaul 656038, Russian Federation |
Abstract |
The present paper is concerned with the research of diffusion mechanism at the grain boundaries in two-dimensional metals by the method of molecular dynamics. The diffusion of atoms was studied on the example of three metals: Ni, Al, Cu. The packing of two-dimensional crystals was corresponded to the plane [111] of FCC lattice. To describe interatomic interactions, pair Morse potentials were used. The metals under study were heated up to the temperatures, corresponded to 0.3 - 0.95 relatively to the melting temperature. Severe boundary constraints were applied on the boundaries of the calculated block.
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Presentation: oral at E-MRS Fall Meeting 2004, Symposium H, by Mikhail D. StarostenkovSee On-line Journal of E-MRS Fall Meeting 2004 Submitted: 2004-04-13 10:47 Revised: 2009-06-08 12:55 |