Modelling diffusion-controlled kinetics in equilibrium and driven alloys |
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Authors: | G. Martin P. Bellon R. Soisson |
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Affiliation: | (1) Department of Metal Physics Research (SRMP), CEA-Saclay, F-91191 Gif-sur-Yvette Cédex, France |
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Abstract: | Summary We introduce a very simple model for thermally activated atomic migration on a lattice, and several techniques to handle it. For thermodynamical systems, the model can be used for simulating decomposition paths taking into account relevant metallurgical features. Close to equilibrium, the simplest mean-field approximation of the model can be linearized with respect to the departure from equilibrium; one then gets a microscopic interpretation of classical phenomenological coefficients, such as mobility, interfacial transfer coefficient, rate constants for the coupled relaxation of concentration and order fields. Further away from the equilibrium, the nonlinearities can be taken into account in a consistent way. For driven alloys, i.e. alloys submitted to external forcing, forced atomic migration is added to the model and new features emerge: the model is supported by several experimental results some of which confirmed its predictions a posteriori. |
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Keywords: | Precipitation Ordering Domain growth Vacancy jumps Kinetic Monte Carlo technique Kinetic mean-field approximation Fe-Cu Fe-Al Ni-Al |
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