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By using molecular dynamics simulations, the research examine how copper and silver nanowires respond to tensile loading in order to clarify their nanoscale deformation mechanisms. The results demonstrate that these two metal nanowires…

Materials Science · Physics 2025-05-02 Xiaorui Hu , Jiawei Xiong

We develop and demonstrate the first general computational tool for finite deformation static and dynamic dislocation mechanics. A finite element formulation of finite deformation (Mesoscale) Field Dislocation Mechanics theory is presented.…

Materials Science · Physics 2020-06-24 Rajat Arora , Xiaohan Zhang , Amit Acharya

Low-angle grain boundaries (LAGBs) are often regarded as penetrable interfaces to dislocation motion, yet recent studies suggest they can also act as strong barriers. The origin of this duality remains debated, particularly regarding the…

Materials Science · Physics 2025-10-02 Shuai Zhang , Zhishun Chen , Zhuoming Xie , Jun Song , Huiqiu Deng , Wangyu Hu , Jie Hou

We report an unexpected characteristic of dislocation cores in silicon. Using first-principles calculations, we show that all the stable core configurations for a non-dissociated 60$^\circ$ dislocation are sessile. The only glissile…

Materials Science · Physics 2015-05-14 Laurent Pizzagalli , Julien Godet , Sandrine Brochard

The impact of twin boundaries (TBs) on the microstructure evolution and plastic deformation mechanisms of face-centered cubic (FCC) metals has been extensively studied since the discovery that nanotwinned materials exhibit a favorable…

Materials Science · Physics 2026-01-28 DeAn Wei , Michael Zaiser , Jing Tang , Xu Zhang

Isolated kinks on thermally fluctuating (1/2)<111> screw, <100> edge and (1/2)<111> edge dislocations in bcc iron are simulated under zero stress conditions using molecular dynamics (MD). Kinks are seen to perform stochastic motion in a…

Materials Science · Physics 2013-02-26 T. D. Swinburne , S. L. Dudarev , S. P. Fitzgerald , M. R. Gilbert , A. P. Sutton

Linear elastic fracture mechanics theory predicts that the speed of crack growth is limited by the Rayleigh wave speed. Although many experimental observations and numerical simulations have supported this prediction, some exceptions have…

Soft Condensed Matter · Physics 2024-01-05 Mohit Pundir , Mokhtar Adda-Bedia , David S. Kammer

The mechanical behaviour of Mg-Al alloys can be largely improved by the formation of an intermetallic Laves phase skeleton, in particular the creep strength. Recent nanomechanical studies revealed plasticity by dislocation glide in the…

Mg grain boundary (GB) segregation and GB diffusion can impact the processing and properties of Al-Mg alloys. Yet, Mg GB diffusion in Al has not been measured experimentally or predicted by simulations. We apply atomistic computer…

Materials Science · Physics 2020-11-05 R. K. Koju , Y. Mishin

Plasticity in hexagonal close packed (HCP) metals and alloys such as Titanium (Ti) and Zirconium (Zr) is carried out by the motion of $\langle a \rangle$ dislocations. Above room temperature, in situ transmission electron microscopy…

Materials Science · Physics 2023-10-25 Ali Rida , Satish I. Rao , Jaafar A. El-Awady

The statistical-thermodynamic dislocation theory developed in previous papers is used here in an analysis of high-temperature deformation of aluminum and steel. Using physics-based parameters that we expect theoretically to be independent…

Materials Science · Physics 2017-07-19 K. C. Le , T. M. Tran , J. S. Langer

The fundamental interactions between an edge dislocation and a random solid solution are studied by analyzing dislocation line roughness profiles obtained from molecular dynamics simulations of Fe0.70Ni0.11 Cr0.19 over a range of stresses…

Understanding the evolution of dislocation structures during plastic deformation is critical for predicting the mechanical performance of metallic materials. In this work, we applied in situ scanning electron microscopy/electron backscatter…

Materials Science · Physics 2026-03-24 Mikhail Lebyodkin , Maxim Gussev , Jamieson Brechtl , Tatiana Lebedkina

The kinetic friction and wear at high sliding speeds is investigated using the head-disk interface of hard disk drives, wherein, the head and the disk are less than 10 nm apart and move at sliding speeds of 5-10 m/s relative to each other.…

Mesoscale and Nanoscale Physics · Physics 2016-05-10 Sukumar Rajauria , Sripathi V. Canchi , Erhard Schreck , Bruno Marchon

At extreme strain rates, where fast moving dislocations govern plastic deformation, anharmonic phonon scattering imparts a drag force on the dislocations. In this paper, we present calculations of the dislocation drag coefficients of…

Materials Science · Physics 2026-01-19 Daniel N. Blaschke , Leonid Burakovsky , Dean L. Preston

Over the past decades, discrete dislocation dynamics simulations have been shown to reliably predict the evolution of dislocation microstructures for micrometer-sized metallic samples. Such simulations provide insight into the governing…

Understanding material behavior under high velocity impact is the key to addressing a variety of fundamental questions in areas ranging from asteroid strikes and geological cratering to impact-induced phase transformations, spallation,…

Materials Science · Physics 2016-12-26 Mostafa Hassani-Gangaraj , David Veysset , Keith A. Nelson , Christopher A. Schuh

Thermally-activated $\small{\nicefrac{1}{2}}<111>$ screw dislocation motion is the controlling plastic mechanism at low temperatures in body-centered cubic (bcc) crystals. Motion proceeds by the nucleation and propagation of atomic-sized…

Materials Science · Physics 2014-08-27 Alexander Stukowski , David Cereceda , Thomas D. Swinburne , Jaime Marian

We report experimental observations of sound waves in a granular material during resonant silo discharge called silo music. The grain motion was tracked by high speed imaging while the resonance of the silo was detected by accelerometers…

Soft Condensed Matter · Physics 2015-05-27 Tamas Borzsonyi , Zsolt Kovacs

The interaction between dislocations is fundamental to plastic deformation, work hardening, and defect accumulation. While extensive research has focused on the impact of solutes on individual dislocations, how solutes affect…

Materials Science · Physics 2024-09-25 Jie Hou , Ducheng Peng , Xiang-Shan Kong , Huiqiu Deng , Wangyu Hu , Cheng Chen , Jun Song