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相关论文: Dual migration modes of unfaulted disconnections o…

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We study the Grain Boundary (GB) migration based on the underlying disconnection structure and mechanism. Disconnections are line defects that lie solely within a GB and are characterized by both a Burgers vector and a step height, as set…

材料科学 · 物理学 2019-10-23 Chaozhen Wei , Spencer L. Thomas , Jian Han , David J. Srolovitz , Yang Xiang

Knowledge about grain boundary migration is a prerequisite for understanding and ultimately modulating the properties of polycrystalline materials. Evidence from experiments and molecular dynamics (MD) simulations suggests that the…

材料科学 · 物理学 2021-12-08 Mahi Gokuli , Brandon Runnels

We present the results of novel, time-resolved, in situ HRTEM observations, molecular dynamics (MD) simulations, and disconnection theory that elucidate the mechanism by which the motion of grain boundaries (GBs) in polycrystalline…

Understanding and controlling the properties and dynamics of topological defects is a lasting challenge in the study of two-dimensional materials, and is crucial to achieve high-quality films required for technological applications. Here…

材料科学 · 物理学 2017-06-28 Doaa Taha , S. K. Mkhonta , K. R. Elder , Zhi-Feng Huang

Understanding the grain boundary deformation dynamics is very crucial to designing materials with stable microstructures. With this quest, the deformation behavior of coherent twin boundary under cyclic shear loading has been studied in…

材料科学 · 物理学 2022-11-24 J. Veerababu , G. Sainath , A. Nagesh

The microstructure of polycrystalline materials consists of networks of grain boundaries (GBs) and triple junctions (TJs), along which three GBs meet. The evolution of such microstructures may be driven by surface tension (capillarity),…

计算物理 · 物理学 2019-08-01 Chaozhen Wei , Luchan Zhang , Jian Han , David J. Srolovitz , Yang Xiang

The grain boundary (GB) mobility relates GB velocity to the thermodynamic driving forces and is central to our understanding of microstructure evolution in polycrystals. Recent molecular dynamics (MD) and experimental studies have shown…

材料科学 · 物理学 2020-11-18 Kongtao Chen , Jian Han , David J. Srolovitz

Interface migration in microstructures is mediated by the motion of line defects with step and dislocation character, i.e., disconnections. We propose a continuum model for arbitrarily-curved grain boundaries or heterophase interfaces…

材料科学 · 物理学 2023-05-15 Caihao Qiu , Marco Salvalaglio , David J. Srolovitz , Jian Han

In this paper, we present a continuum model for the dynamics of low angle grain boundaries in two dimensions based on the motion of constituent dislocations of the grain boundaries. The continuum model consists of an equation for the motion…

材料科学 · 物理学 2018-06-13 Luchan Zhang , Yang Xiang

Disconnections, long recognized as the key mediators of grain boundary (GB) kinetics in polycrystalline materials, have traditionally been understood to nucleate through thermal or mechanical activation. In this work, using atomistic…

材料科学 · 物理学 2026-03-09 Zuoyong Zhang , Chuang Deng

The impact of twin boundaries (TBs) on the microstructure evolution and plastic deformation mechanisms of face-centered cubic (FCC) metals has been extensively studied since the discovery that nanotwinned materials exhibit a favorable…

材料科学 · 物理学 2026-01-28 DeAn Wei , Michael Zaiser , Jing Tang , Xu Zhang

The dynamical mechanisms underlying the grain evolution and growth are of fundamental importance in controlling the structural properties of large-scale polycrystalline materials, but the effects of lattice ordering and distinct atomic…

材料科学 · 物理学 2022-01-03 Brendon Waters , Zhi-Feng Huang

By analyzing the interface defect loop nucleation and the interface disconnection expansion in dynamic simulations, the elementary migration process of coherent twin boundary of magnesium is identified to be independent unit cell…

介观与纳米尺度物理 · 物理学 2017-11-03 Xiao-Zhi Tang , Qun Zu , Ya-Fang Guo

The migration of grain boundaries leads to grain growth in polycrystals and is one mechanism of grain-boundary-mediated plasticity, especially in nanocrystalline metals. This migration is due to the movement of dislocation-like defects,…

材料科学 · 物理学 2024-05-09 Swetha Pemma , Rebecca Janisch , Gerhard Dehm , Tobias Brink

The migration of grain boundaries leads to grain growth in polycrystals and is one mechanism of grain-boundary-mediated plasticity, especially in nanocrystalline metals. This migration is due to the movement of dislocation-like defects,…

材料科学 · 物理学 2024-07-08 Swetha Pemma , Rebecca Janisch , Gerhard Dehm , Tobias Brink

The thermodynamic theory of dislocation/grain boundary interaction, including dislocation pile-up against, absorption by, and transfer through the grain boundary, is developed for nonuniform plastic deformations in polycrystals. The case…

材料科学 · 物理学 2022-03-14 Yinguang Piao , Khanh Chau Le

In this work, we investigate the shape evolution of rotated, embedded, initially cylindrical grains (with [001] cylinder axis) in Ni under an applied synthetic driving force via molecular dynamics simulations and a continuum,…

材料科学 · 物理学 2024-08-28 Anqi Qiu , Caihao Qiu , Ian Chesser , Jian Han , David Srolovitz , Elizabeth Holm

High energy x-ray diffraction microscopy was used to image the microstructure of $\alpha$-Fe before and after a 600 $^\circ$C anneal. These data were used to determine the areas, curvatures, energies, and velocities of approximately 40,000…

Atomistic simulations provide the most detailed picture of grain boundary (GB) migration currently available. Nevertheless, extracting unit mechanisms from atomistic simulation data is difficult because of the zoo of competing,…

材料科学 · 物理学 2025-06-06 Ian Chesser , Brandon Runnels , Elizabeth Holm

Grain boundaries can exist as different grain boundary phases (also called complexions) with individual atomic structures. The thermodynamics of these defect phases in high-angle grain boundaries were studied mostly with atomistic and phase…

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