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The Continuum Dislocation Dynamics (CDD) theory and the Discrete Dislocation Dynamics (DDD) method are compared based on concise mathematical formulations of the coarse graining of discrete data. A numerical tool for converting from a…

Materials Science · Physics 2016-03-03 Stefan Sandfeld , Giacomo Po

In continuum models of dislocations, proper formulations of short-range elastic interactions of dislocations are crucial for capturing various types of dislocation patterns formed in crystalline materials. In this article, the continuum…

Materials Science · Physics 2016-08-12 Yichao Zhu , Xiaohua Niu , Yang Xiang

Numerical studies of dislocation pair correlations have played a central role in deriving a continuum theory from the equations of motion of 2D dislocation systems in a mathematically rigorous way. As part of an effort to extend this theory…

Materials Science · Physics 2008-12-05 Ferenc F. Csikor , István Groma , Thomas Hochrainer , Daniel Weygand , Michael Zaiser

Continuum dislocation dynamics (CDD) represents the evolution of systems of curved and connected dislocation lines in terms of density-like field variables which include the volume density of loops (or 'curvature density') as an additional…

Materials Science · Physics 2023-01-04 Xi Luo , Michael Zaiser

Discrete dislocation dynamics (DDD) is a widely employed computational method to study plasticity at the mesoscale that connects the motion of dislocation lines to the macroscopic response of crystalline materials. However, the…

Materials Science · Physics 2023-05-24 Nicolas Bertin , Fei Zhou

Plasticity is governed by the evolution of, in general anisotropic, systems of dislocations. We seek to faithfully represent this evolution in terms of density-like variables which average over the discrete dislocation microstructure.…

Materials Science · Physics 2016-09-21 Mehran Monavari , Stefan Sandfeld , Michael Zaiser

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…

In order to predict the long-term effects of irradiation on the material properties of tungsten, a continuum approach to simulating the interactions of dislocation loops, which arise from radiation damage, is proposed. Continuum models of…

Materials Science · Physics 2026-04-20 Joseph Duque Lopez , Sergei Dudarev , James Kermode , Thomas Hudson

A model for ionic and electronic grain boundary transport through thin films, scales or membranes with columnar grain structure is introduced. The grain structure is idealized as a lattice of identical hexagonal cells - a honeycomb pattern.…

Materials Science · Physics 2017-05-05 M. P. Tautschnig , N. M. Harrison , M. W. Finnis

The properties of the processes of deformation of a packing of rigid grains are analysed when the exact distribution of the normal forces at contacts is known. Importance of grain rotation and of counter-rotation of adjacent grains is…

Soft Condensed Matter · Physics 2007-05-23 P. Evesque

The problem of mass diffusion in layered systems has relevance to applications in different scientific disciplines, e.g., chemistry, material science, soil science, and biomedical engineering. The mathematical challenge in these type of…

Statistical Mechanics · Physics 2020-10-28 Oded Farago

Triple junctions, line defects formed by the intersection of different grain boundaries, exist within all polycrystalline materials. While it has long been recognized that triple junctions could play an important role in microstructural…

Materials Science · Physics 2026-05-21 Ian S Winter , R. Daniel Moore , R. E. Rudd , T. Oppelstrup , T. Frolov

Microscopic models of the interaction between grain boundaries (GBs) and both dislocations and cracks are of importance in understanding the role of microstructure in altering the mechanical properties of a material. A recently developed…

Materials Science · Physics 2009-10-30 V. B. Shenoy , R. Miller , E. B. Tadmor , R. Phillips , M. Ortiz

The presence of interfaces and grain boundaries significantly impacts the mechanical properties of materials, particularly when dealing with micro- or nano-scale samples. Distinct interactions between dislocations and grain boundaries can…

Materials Science · Physics 2025-05-08 Jinxin Yu , Alfonso H. W. Ngan , David J. Srolovitzb , Jian Hana

We investigate the depinning transition occurring in dislocation assemblies. In particular, we consider the cases of regularly spaced pileups and low angle grain boundaries interacting with a disordered stress landscape provided by solute…

Statistical Mechanics · Physics 2009-11-10 Paolo Moretti , M. -Carmen Miguel , Michael Zaiser , Stefano Zapperi

Recent grain growth experiments have revealed that the same type of grain boundary can have very different mobilities depending on its local microstructure. In this work, we use molecular dynamics simulations to quantify uncertainty in the…

Materials Science · Physics 2022-11-17 Anqi Qiu , Ian Chesser , Elizabeth Holm

Dislocation dynamics simulation is used to investigate the effect of grain size and grain shape on the flow stress in model copper grains. We consider grains of 1.25-10 $\mu$m size, three orientations (<135>, <100> and <111>) and three…

Materials Science · Physics 2019-03-06 Maoyuan Jiang , Benoit Devincre , Ghiath Monnet

The continuum mechanics of line defects representing singularities due to terminating discontinuities of the elastic displacement and its gradient field is developed. The development is intended for application to coupled phase…

Materials Science · Physics 2016-03-09 Amit Acharya , Claude Fressenegeas

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…

Materials Science · Physics 2017-06-28 Doaa Taha , S. K. Mkhonta , K. R. Elder , Zhi-Feng Huang

The dynamics of dislocations confined to grain boundaries in a striped system are studied using electroconvection in the nematic liquid crystal N4. In electroconvection, a striped pattern of convection rolls forms for sufficiently high…

Soft Condensed Matter · Physics 2009-11-10 Carina Kamaga , Fatima Ibrahim , Michael Dennin