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Most technologically useful materials are polycrystalline microstructures composed of a myriad of small monocrystalline grains separated by grain boundaries. The energetics and connectivities of grain boundaries play a crucial role in…

偏微分方程分析 · 数学 2020-08-20 Yekaterina Epshteyn , Chun Liu , Masashi Mizuno

Many technologically useful materials are polycrystals composed of a myriad of small monocrystalline grains separated by grain boundaries. Dynamics of grain boundaries play a crucial role in determining the grain structure and defining the…

材料科学 · 物理学 2021-07-07 Katayun Barmak , Anastasia Dunca , Yekaterina Epshteyn , Chun Liu , Masashi Mizuno

A novel continuum theory of incoherent interfaces with triple junctions is applied to study three-dimensional coupled grain boundary (GB) motion in polycrystalline materials. The kinetic relations for grain dynamics, relative sliding and…

材料科学 · 物理学 2017-02-08 Anup Basak , Anurag Gupta

The mathematical model of grain boundary motion, including lattice misorientations' effect, is considered. When time-dependent lattice misorientations are state variables of the surface tension of the grain boundary, to ensure the energy…

偏微分方程分析 · 数学 2022-05-09 Takashi Kagaya , Masashi Mizuno , Keisuke Takasao

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

Many technologically useful materials are polycrystals composed of small monocrystalline grains that are separated by grain boundaries of crystallites with different lattice orientations. The energetics and connectivities of the grain…

偏微分方程分析 · 数学 2021-06-29 Yekaterina Epshteyn , Chun Liu , Masashi Mizuno

A discrete model and the regular solution approximation are applied to describe the effect of grain boundary motion on grain boundary phase transformations in a binary alloy. The model predicts all thermodynamic properties of the grain…

材料科学 · 物理学 2019-05-13 Y. Mishin

Grain rotation and grain boundary (GB) sliding are two important mechanisms for grain coarsening and plastic deformation in nanocrystalline materials. They are in general coupled with GB migration and the resulting dynamics, driven by…

材料科学 · 物理学 2014-12-30 Anup Basak , Anurag Gupta

Coupled grain boundary (GB) motion has been studied in a two-dimensional tricrystal where a cylindrical grain is embedded at the center of the planar GB of a large bicrystal. Kinetic relations for GB dynamics, grain orientations, and…

材料科学 · 物理学 2014-07-15 Anup Basak , Anurag Gupta

Polycrystalline materials can be viewed as composites of crystalline particles or grains separated from one another by thin amorphous grain boundary (GB) regions. While GB have been exhaustively investigated at low temperatures, where these…

材料科学 · 物理学 2015-05-13 Hao Zhang , David J. Srolovitz , Jack F. Douglas* , James A. Warren

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

We prove a local existence result for a PDE system that describes curvature motion of networks with a dynamic boundary condition known as triple junction drag. This model arises in the study of grain boundary evolution in polycrystalline…

偏微分方程分析 · 数学 2025-09-09 Yuchuan Yang , Selim Esedoglu

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 dynamics of dislocation assemblies in deforming crystals indicate the emergence of collective phenomena, intermittent fluctuations and strain avalanches. In polycrystalline materials, the understanding of plastic deformation mechanisms…

材料科学 · 物理学 2009-11-13 Paolo Moretti , Lasse Laurson , Mikko J. Alava

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

This paper investigates the statistical behavior of two-dimensional grain microstructures during grain growth under anisotropic grain boundary characters. We employ the threshold-dynamics method, which allows for unparalleled computational…

材料科学 · 物理学 2023-09-19 Jaekwang Kim , Nikhil Chandra Admal

Synthetic driving force molecular dynamics simulations were utilized to survey grain boundary mobility in three classes of incoherent {\Sigma}3 twin boundaries: <112>, <110>, and <111> tilt boundaries. These boundaries are faceted on low…

材料科学 · 物理学 2017-04-12 Jonathan Humberson , Elizabeth A. Holm

Grain boundaries control a wide variety of bulk properties in polycrystalline materials, so simulation methods like density functional theory are routinely used to study their structure-property relationships. A standard practice for such…

材料科学 · 物理学 2023-08-29 Malik Wagih , Christopher A. Schuh

Most metallic and ceramic materials are comprised of a space-filling collection of crystalline grains separated by grain boundaries. While this grain structure has been studied for more than a century, there few rigorous results regarding…

材料科学 · 物理学 2021-10-29 Erdem Eren , Jeremy Kyle Mason

Experiments, theory and atomistic simulations show that finite triple junction mobility results in non-equilibrium triple junction angles in evolving polycrystalline systems. These angles have been predicted and verified for cases where…

材料科学 · 物理学 2017-02-07 Quan Zhao , Wei Jiang , David J. Srolovitz , Weizhu Bao
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