Theoretical studies of surface diffusion: Self-diffusion in the fcc(100) system
- 15 March 1983
- journal article
- Published by AIP Publishing in The Journal of Chemical Physics
- Vol. 78 (6) , 3219-3222
- https://doi.org/10.1063/1.445238
Abstract
Surface self-diffusion constants for the fcc(100) Lennard–Jonesium system were calculated using classical molecular dynamics methods. Self-diffusion Arrhenius parameters calculated using pair potentials derived from bulk thermodynamic data were found to be in good agreement with reported Rh(100) experimental values.Keywords
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