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Related papers: A Continuum Multi-Disconnection-Mode Model for Gra…

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The grain boundary (GB) microstructure influences and is influenced by the development of residual stresses during synthesis of polycrystalline thin films. Recent studies have shown that the frustration between the preferred growth…

Materials Science · Physics 2022-12-14 Mengyuan Wang , Ruilin Yan , Xiao Han , Hailong Wang , Moneesh Upmanyu

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…

Mesoscale and Nanoscale Physics · Physics 2017-11-03 Xiao-Zhi Tang , Qun Zu , Ya-Fang Guo

Four different finite element level-set (FE-LS) formulations are compared for the modeling of grain growth in the context of polycrystalline structures and, moreover, two of them are presented for the first time using anisotropic grain…

Materials Science · Physics 2021-08-04 Brayan Murgas , Sebastian Florez , Nathalie Bozzolo , Julien Fausty , Marc Bernacki

Grain boundaries (GBs), an important constituent of polycrystalline materials, have a wide range of manifestion and significantly affect the properties of materials. Fully understanding the effects of GBs is stalemated due to lack of…

Materials Science · Physics 2021-03-19 Cheng-yan Liu , Zhi-ming Li , Xin-gao Gong

Grain boundary roughness can affect electronic and mechanical properties of two-dimensional materials. This roughness depends crucially on the growth process by which the two-dimensional material is formed. To investigate the key mechanisms…

Materials Science · Physics 2022-04-06 Fabio D. A. Aarão Reis , Bastien Marguet , Olivier Pierre-Louis

Grain boundaries (GBs) in polycrystalline materials are powerful sinks for irradiation defects. While standard theories assume that the sink efficiency of a grain boundary is defined solely by its character before irradiation, recent…

In this paper, we present a continuum model to compute the energy of low angle grain boundaries for any given degrees of freedom (arbitrary rotation axis, rotation angle and boundary plane orientation) based on a continuum dislocation…

Materials Science · Physics 2016-12-20 Luchan Zhang , Yejun Gu , Yang Xiang

Grain-boundary (GB) dynamics control the stability, mechanical, and functional response of nanocrystalline materials, but direct experimental access to their slow non-equilibrium motion has been limited. Here we establish X-ray photon…

In light of the race towards macroscale superlubricity of graphitic contacts, the effect of grain boundaries on their frictional properties becomes of central importance. Here, we elucidate the unique frictional mechanisms characterizing…

Mesoscale and Nanoscale Physics · Physics 2020-08-04 Xiang Gao , Wengen Ouyang , Oded Hod , Michael Urbakh

For potentially wider applications of ceramics with dislocation-tuned mechanical and functional properties, it is pertinent to achieve dislocation engineering in polycrystalline ceramics. However, grain boundaries (GBs) in general are…

Materials Science · Physics 2025-09-08 Kuan Ding , Atsutomo Nakamura , Patrick Cordier , Xufei Fang

Hydrogen grain boundary (GB) trapping is widely accepted as the main cause for hydrogen induced intergranular failure. Several studies were conducted to unveil the role of GBs on hydrogen transport; however, a clear understanding is yet to…

Materials Science · Physics 2024-12-30 Abdelrahman Hussein , Byungki Kim , Tom Depover , Kim Verbeken

The formation of basal/prismatic (BP) interfaces accompanying with the nucleation and growth of a reoriented crystal in Mg single-crystals under c-axis tension is investigated by molecular dynamics simulations. The BP interfaces nucleate by…

Materials Science · Physics 2017-04-07 Qun Zu , Xiaozhi Tang , Shuang Xu , Yafang Guo

Grain growth competition during directional solidification of a polycrystal with hexagonal (hcp) symmetry (Mg-1wt%Gd alloy) is studied by phase-field modeling, exploring the effect of the temperature gradient G on the resulting grain…

Materials Science · Physics 2024-03-15 A. K. Boukellal , M. Sarebanzadeh , A. Orozco-Caballero , F. Sket , J. LLorca , D. Tourret

The initiation of intergranular corrosion at various types of grain boundaries (GBs) was studied at the nanometer scale on microcrystalline copper in 1 mM HCl aqueous solution. In situ Electrochemical Scanning Tunneling Microscopy (ECSTM)…

Engineering structure of grain boundaries (GBs) by solute segregation is a promising strategy to tailor the properties of polycrystalline materials. Theoretically it has been suggested that solute segregation can trigger phase transitions…

Materials Science · Physics 2025-01-28 Vivek Devulapalli , Enze Chen , Tobias Brink , Timofey Frolov , Christian H. Liebscher

Grain boundary (GB) enthalpies in nanocrystalline (NC) $\mathrm {Pd_{90}Au_{10}}$ are studied after preparation, thermal relaxation and plastic deformation. By comparing results from atomistic computer simulations and calorimetry, we show…

Materials Science · Physics 2014-12-10 Michael Johannes Deckarm , Jonathan Schäfer , Karsten Albe , Rainer Birringer

We propose a generalized version of the Dielectric Breakdown Model (DBM) for generic breakdown processes. It interpolates between the standard DBM and its analog with quenched disorder, as a temperature like parameter is varied. The physics…

Condensed Matter · Physics 2016-08-31 R. Cafiero , A. Gabrielli , M. Marsili , M. A. Muñoz , L. Pietronero

We introduce a grain boundary (GB) translation vector, $\textbf{t}^{WS}$, to describe and quantify the domain of the microscopic degrees of freedom of GBs. It has long been recognized that for fixed macroscopic degrees of freedom of a GB…

Materials Science · Physics 2025-01-10 Ian S. Winter , Timofey Frolov

A recently developed model that unifies the ballistic and diffusive transport mechanisms is applied in a theoretical study of carrier transport across potential barriers at grain boundaries in microcrystalline semiconducting materials. In…

Materials Science · Physics 2009-11-07 T. Weis , R. Lipperheide , U. Wille , S. Brehme

A linear bubble model of grain growth is introduced to study the conditions under which an isolated grain can grow to a size much larger than the surrounding matrix average (abnormal growth). We first consider the case of bubbles of two…

Materials Science · Physics 2007-05-23 W. W. Mullins , Jorge Vinals