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DOE OSTI · 3364376

A general kinetic framework for dislocation mobility derived from probabilistic cellular automaton simulations of the kink-pair mechanism

Abstract

Dislocation mobility laws are essential components of dislocation-density-based crystal plasticity models. For dislocations governed by the kink-pair mechanism, however, existing formulations are typically limited to specific regimes due to the com plex interplay between stochastic kink-pair nucleation and lateral kink migration. In this work, we develop a general kinetic framework that expresses the average dislocation velocity as a function of mechanism-level variables: positive/negative kink pair nucleation rates, kink migration velocity, dislocation segment length, critical kink-pair width, and kink height. Probabilis tic cellular automaton simulations are used to capture the behavior of conceptual dislocation segments between the limiting conditions of migration outpacing nucleation on the one end and nucleation outpacing migration on the other. An elemen tary functional form that captures the system dynamics is suggested and fitted against the simulation results. This framework remains valid for arbitrary combinations of the six variables and is, therefore, compatible with any admissible constitutive re lations that describe their stress and temperature dependence. Comparisons with established approaches and experimental results confirm the robustness and physical consistency of the formulation, making it broadly applicable to material systems in which dislocation motion is governed by the kink-pair mechanism.

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BibTeXRIS

Bing, Cathy [Michigan State Univ., East Lansing, MI (United States)] (ORCID:0000000171908647), Eisenlohr, Philip [Michigan State Univ., East Lansing, MI (United States)] (ORCID:0000000282205995). 2025-12-27. A general kinetic framework for dislocation mobility derived from probabilistic cellular automaton simulations of the kink-pair mechanism. https://doi.org/10.1016/j.actamat.2025.121876

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36 MATERIALS SCIENCE