English
Related papers

Related papers: PyDislocDyn: A Python code for calculating disloca…

200 papers

Dislocations in crystalline materials are widely exploited to tailor the thermal conductivity of semiconductors and thermoelectrics, yet a critical gap persists: direct measurement of local thermal resistance at individual buried…

Materials Science · Physics 2026-05-20 Ruilin Mao , Bingyao Liu , Jiaxin Liu , Xiaoyue Gao , Junping Luo , Fachen Liu , Ruochen Shi , Jiade Li , Jinlong Du , Peng Gao

There is growing interest in functional, adaptive devices built from colloidal subunits of micron size or smaller. A colloidal material with dynamic mechanical properties could facilitate such microrobotic machines. Here we study via…

Soft Condensed Matter · Physics 2020-01-01 Bryan VanSaders , Sharon C. Glotzer

The stability of the perfect screw dislocation in silicon has been investigated using both classical potentials and first-principles calculations. Although a recent study by Koizumi et al . stated that the stable screw dislocation was…

Materials Science · Physics 2007-09-12 Laurent Pizzagalli , Pierre Beauchamp , Jacques Rabier

Responding to a lack in the literature, mechanical properties of polygonal wood particles are determined for use in a discrete element model (DEM) for flow analysis in silos, and some methods are proposed for determining such parameters.…

We present an open source Python 3 library aimed at practitioners of molecular simulation, especially Monte Carlo simulation. The aims of the library are to facilitate the generation of simulation data for a wide range of problems; and to…

The thermodynamic dislocation theory developed for non-uniform plastic deformations is used here in an analysis of a bar subjected to torsion. Employing a small set of physics-based parameters, which we expect to be approximately…

Soft Condensed Matter · Physics 2019-01-02 K. C. Le , Y. Piao , T. M. Tran

This paper develops a geometrical model of dislocations and disclinations in single crystals at the mesoscopic scale. In the continuation of previous work the distribution theory is used to represent concentrated effects in the defect lines…

Mathematical Physics · Physics 2015-03-13 Nicolas Van Goethem , Francois Dupret

Drell-Yan lepton pair production processes are extremely important for Standard Model (SM) precision tests and for beyond the SM searches at hadron colliders. Fast and accurate predictions are essential to enable the best use of the…

We derive a continuum-level plasticity model for polycrystalline materials in the high energy density regime, based on a single dislocation density and single mobility mechanism, with an evolution model for the dislocation density. The…

Electroplasticity is defined as the reduction in flow stress of a material undergoing deformation on passing an electrical pulse through it. The lowering of flow stress during electrical pulsing has been attributed to a combination of three…

Materials Science · Physics 2020-01-08 Arka Lahiri , Pratheek Shanthraj , Franz Roters

The present work is essentially concerned with the development of statistical theory for the low temperature dislocation glide in concentrated solid solutions where atom-sized obstacles impede plastic flow. In connection with such a…

Statistical Mechanics · Physics 2015-05-13 Laurent Proville

Dislocations are fundamental crystal defects whose stress fields govern a wide range of material properties. The analytical form of the stress tensor around single dislocation was established by elasticity theory more than 80 years ago and…

Materials Science · Physics 2026-01-05 Takeyuki Tsuji , Shunta Harada , Tokuyuki Teraji

The theory of the depinning transition of elastic manifolds in random media provides a framework for the statistical dynamics of dislocation systems at yield. We consider the case of a single flexible dislocation gliding through a random…

Materials Science · Physics 2007-05-23 Stefano Zapperi , Michael Zaiser

As circuitry approaches single nanometer length scales, it is important to predict the stability of metals at these scales. The behavior of metals at larger scales can be predicted based on the behavior of dislocations, but it is unclear if…

We show that a microscopic definition of crystal defect, based on the effective mean single-particle potential energy, makes it possible to detect and visualize various types of local and extended crystal defects and develop an effective…

Materials Science · Physics 2007-05-23 M. Patriarca , M. Robles , K. Kaski

Dislocations govern the properties of any crystals. Yet, how dislocation of pentagonheptagon (5|7) in grain boundaries (GBs) affects the mechanical properties of two-dimensional MoS2 crystals remains poorly known. Using atomistic…

Materials Science · Physics 2021-07-13 Li Yang , Jinjie Liu , Yanwen Lin , Ke Xu , Xuezheng Cao , Zhisen Zhang , Jianyang Wu

This paper presents a lightweight, open-source and high-performance python package for solving peridynamics problems in solid mechanics. The development of this solver is motivated by the need for fast analysis tools to achieve the large…

Software Engineering · Computer Science 2021-09-15 B. Boys , T. J. Dodwell , M. Hobbs , M. Girolami

This article reviews the current status of lattice-dynamical calculations in crystals, using density-functional perturbation theory, with emphasis on the plane-wave pseudo-potential method. Several specialized topics are treated, including…

Materials Science · Physics 2009-10-31 S. Baroni , S. de Gironcoli , A. Dal Corso , P. Giannozzi

Defects are inevitable during the manufacturing processes of materials. Presence of these defects and their dynamics significantly influence the responses of materials. A thorough understanding of dislocation dynamics of different types of…

Materials Science · Physics 2024-08-28 Santosh Chhetri , Maryam Naghibolhosseini , Mohsen Zayernouri

Intriguing analogies were found between a model of plastic deformation in crystals and turbulence in fluids. A study of this model provides remarkable explanations of known experiments and predicts fractal dislocation pattern formation.…

Computational Physics · Physics 2012-01-20 Woosong Choi , Yong S. Chen , Stefanos Papanikolaou , James P. Sethna