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We provide a well-posedness analysis of a kinetic model for grain growth introduced by Fradkov which is based on the von Neumann-Mullins law. The model consists of an infinite number of transport equations with a tri-diagonal coupling…

Analysis of PDEs · Mathematics 2008-12-27 Reiner Henseler , Michael Herrmann , Barbara Niethammer , Juan J. L. Velazquez

The interaction of screw dislocations with an applied stress is studied using atomistic simulations in conjunction with a continuum treatment of the role played by the far field boundary condition. A finite cell of atoms is used to consider…

Materials Science · Physics 2009-10-28 Vijay B. Shenoy , Rob Phillips

Nanocrystalline (NC) materials are intrinsically unstable against grain growth. Significant research efforts have been dedicated to suppressing the grain growth by solute segregation, including the pursuit of a special NC structure that…

Materials Science · Physics 2024-12-09 Omar Hussein , Yuri Mishin

Crystal plasticity is the result of the motion and interaction of dislocations. There is, however, still a major gap between microscopic and mesoscopic simulations and continuum crystal plasticity models. Only recently a higher dimensional…

Materials Science · Physics 2010-10-15 Thomas Hochrainer , Michael Zaiser , Peter Gumbsch

In this paper, transient granular flows are examined both numerically and experimentally. Simulations are performed using the continuous 3D granular model introduced in Daviet & Bertails-Descoubes (2016), which represents the granular…

Grain boundaries (GBs) merge and grains disappear during microstructure evolution. However, the Peach-Koehler model predicts that particular stress states may reverse such a process by exerting differential Peach-Koehler forces on different…

Materials Science · Physics 2025-09-04 Wei Wan , Changxin Tang , Eric R Homer

The high-pressure compaction of three dimensional granular packings is simulated using a bonded particle model (BPM) to capture linear elastic deformation. In the model, grains are represented by a collection of point particles connected by…

Soft Condensed Matter · Physics 2023-10-19 Joel T. Clemmer , Joseph M. Monti , Jeremy B. Lechman

We present a methodology for simulating three-dimensional flow of incompressible viscoplastic fluids modelled by generalised Newtonian rheological equations. It is implemented in a highly efficient framework for massively parallelisable…

Fluid Dynamics · Physics 2019-09-17 Knut Sverdrup , Ann Almgren , Nikolaos Nikiforakis

Dissipative models for the quasi-static and dynamic response due to slip in an elastic body containing a single slip plane of vanishing thickness are developed. Discrete dislocations with continuously distributed cores can glide on this…

Materials Science · Physics 2025-05-30 Amit Acharya

The internal energy associated with the defect microstructure of strongly deformed crystals provides an important driving force for grain boundary motion during recrystallization. Typical dislocation microstructures are strongly…

Materials Science · Physics 2026-01-13 Yufan Zhang , Michael Zaiser

Composite of two kinds of grains is modeled in two-dimension and the elasticity is calculated using molecular dynamics method implementing Gear predictor-corrector of fifth order. It has been observed that same composite concentration can…

Soft Condensed Matter · Physics 2014-02-10 Sparisoma Viridi , Widayani , Siti Nurul Khotimah

We analyze the dislocation content of grain boundary (GB) phase junctions, i.e., line defects separating two different GB phases coexisting on the same GB plane. While regular GB disconnections have been characterized for a variety of…

Materials Science · Physics 2021-05-26 T. Frolov , D. L. Medlin , M. Asta

Discontinuous dynamical systems with grazing solutions are discussed. The group property, continuation of solutions, continuity and smoothness of motions are thoroughly analyzed. A variational system around a grazing solution which depends…

Dynamical Systems · Mathematics 2016-04-20 Marat Akhmet , Aysegul Kivilcim

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,…

Materials Science · Physics 2025-06-06 Ian Chesser , Brandon Runnels , Elizabeth Holm

We present a thermodynamically consistent constitutive model for fluid-saturated sediments, spanning dense to dilute regimes, developed from the basic balance laws for two phase-mixtures. The model can represent various limiting cases, such…

Soft Condensed Matter · Physics 2021-05-18 Aaron S. Baumgarten , Ken Kamrin

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…

Analysis of PDEs · Mathematics 2021-06-29 Yekaterina Epshteyn , Chun Liu , Masashi Mizuno

A limited mobility nonequilibrium solid-on-solid dynamical model for kinetic surface growth is introduced as a simple description for the morphological evolution of a growing interface under random vapor deposition and surface diffusion…

Statistical Mechanics · Physics 2009-10-31 S. Das Sarma , P. Punyindu

The aim of this article is to provide a scheme for simulating diffusion processes evolving in one-dimensional discontinuous media. This scheme does not rely on smoothing the coefficients that appear in the infinitesimal generator of the…

Probability · Mathematics 2007-05-23 Antoine Lejay , Miguel Martinez

Thermodynamic dislocation theory incorporating dislocation impediment by the grain boundaries is developed to analyze the shear test of polycrystals. With a small set of physics based material parameters, we are able to simulate the…

Materials Science · Physics 2021-04-13 Yinguang Piao , Khanh Chau Le

We develop a framework for constitutive modeling of unsaturated soils that has the embedded elements of lower scale grain to grain contacts. Continuum models developed from this framework will possess two different phases idealizing the…

Soft Condensed Matter · Physics 2014-01-28 Giang D. Nguyen , Yixiang Gan