Abstract

We report on a preliminary modelling effort to understand the influence of compositional inhomogeneity on alloy microplasticity from a dislocation dynamics perspective. We tackle this problem by multiscale simulations in three steps: (1) analysis of the 3D composition morphology in alloys with tendency to undergo spinodal instability both thermally and under irradiation, with bcc FeCrAl alloys as a model system, (2) atomistic simulation of the dislocation mobility as a function of the local alloy composition, and (3) using dislocation dynamics simulations to understand the impact of composition inhomogeneity on microplasticity. The dislocation dynamics model takes into consideration the coherency stress associated with composition inhomogeneity when computing the forces driving the dislocation motion and on cross slip. Our preliminary investigation shows that the stress-strain response of the alloy and the dislocation density evolution depend on the wavelength of the composition fluctuations. Our investigation also shows that the alloy inhomogeneity may alter the cross-slip activity, which, in turn, influences the dislocation density evolution. The dependence of the dislocation mobility and coherency stress on local composition and its variation, as well as the altered cross slip rates, cause the dislocation microstructure to differ relative to that in the homogeneous alloy of the same average composition.

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