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Meeting 2026 TMS Annual Meeting & Exhibition
Symposium Hume-Rothery Symposium: Interface Structure and Properties: Impact on Microstructure Evolution
Presentation Title Revisiting Grain Growth: The Impact of Internal Stress on Grain Boundary Migration
Author(s) Caihao Qiu, David J. Srolovitz, Gregory S. Rohrer, Jian Han, Marco Salvalaglio
On-Site Speaker (Planned) Caihao Qiu
Abstract Scope Grain growth describes the increase in mean grain size during the annealing of polycrystals, traditionally attributed to capillarity, where grain boundaries (GBs) migrate toward centers of mean curvature (i.e., mean curvature flow, including its anisotropic extensions for GB energy and mobility). However, this mean curvature flow model has proven overly simplistic and inconsistent with recent experimental and atomistic simulation data. We demonstrate that internal stress generated by GB shear coupling during GB migration is a primary factor causing deviations from the conventional curvature-based model. We employ a bicrystallography-respecting continuum model for GB migration that utilizes a diffuse-interface approach. Our findings, validated through atomistic simulations, show that the scatter in the GB curvature-velocity relationship closely aligns with experimental results for grain growth in 3D polycrystals, a phenomenon inadequately explained by previous models. This work highlights the critical role of mechanical effects in understanding grain growth in crystalline solids.
Proceedings Inclusion? Planned:
Keywords Modeling and Simulation, Computational Materials Science & Engineering,

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Energetic Pathways to Twin Networks and Amorphous Phases in Ni Superalloy and High-Entropy Alloy Thin Films
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Microstructural Evolution Studies with the Potts Model
Microstructure Evolution in Thin Films: Solid-State Dewetting Scenarios and Tailoring Self-Assembly
Microstructure of Ultraelastic Chemically Complex Alloys from Machine Learning – assisted Atomistic Simulations
Multi-Scale Simulations of Deformation and Failure Behaviours in Polycrystalline Multi-Principal Element Alloys
Predicting Plastic Slip Transfer across Interfaces in Crystals: A Scale-Bridging Mechanistic Approach
Reinforcement Learning-Guided Long-Timescale Atomistic Simulations
Revisiting Grain Growth: The Impact of Internal Stress on Grain Boundary Migration
Room-temperature recrystallization of molybdenum induced by nanoindentation
Segregation in Binary Cubic Oxides, and CVD of Diamond Films: A Tale of Two Disparate Dissertation Topics
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