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Molecular dynamics simulations indicate that surfaces strongly influence the strain localization behavior of amorphous nanowires in tension. A sample preparation routine that simulates casting was employed to facilitate the relaxation of…

材料科学 · 物理学 2015-05-18 Yunfeng Shi

We deform, in pure shear, a thin sample of Cu$_{50}$Zr$_{50}$ metallic glass using a molecular dynamics simulation up to, and including, failure. The experiment is repeated ten times in order to have average values and standard deviations.…

材料科学 · 物理学 2020-02-19 Matias Sepulveda-Macias , Gonzalo Gutierrez , Fernando Lund

We study the tensile deformation behaviour of metallic glass Cu$_{50}$Zr$_{50}$ as a function of quenching rate using molecular dynamics simulations. The atomic scale shearing is found to be independent on atomic free volume, and the…

材料科学 · 物理学 2019-01-17 Chunguang Tang , Hailong Peng , Yu Chen , Michael Ferry

Seemingly identical Bulk Metallic Glasses (BMG) often exhibit strikingly different mechanical properties despite having the same composition and fictive temperature. A postulated mechanism underlying these differences is the presence of…

无序系统与神经网络 · 物理学 2025-04-03 Siya Zhu , Hagen Eckert , Stefano Curtarolo , Jan Schroers , Axel van de Walle

Relaxation of shear bands in a Pd40Ni40P20 bulk metallic glass was investigated by a combination of radiotracer diffusion and molecular dynamics (MD) simulations, allowing to determine for the first time the effective activation enthalpy of…

材料科学 · 物理学 2015-09-15 I. Binkowski , G. P. Shrivastav , J. Horbach , S. V. Divinski , G. Wilde

We report atomistic simulation results which indicate that the location of shear banding in a metallic glass (MG) can be ascertained with reasonably high accuracy solely from the undeformed static structure. Correlation is observed between…

材料科学 · 物理学 2022-09-15 Z. Fan , E. Ma , M. L. Falk

High pressure shear band formation is a critical phenomenon in energetic materials due to its influence on both mechanical strength and mechanochemical activation. While shear banding is know to occur in a variety of these materials, the…

材料科学 · 物理学 2024-02-14 Brenden W. Hamilton , Timothy C. Germann

The mechanical properties of amorphous solids like metallic glasses can be dramatically changed by adding small concentrations (as low as 0.1\%) of foreign elements. The glass-forming-ability, the ductility, the yield stress and the elastic…

材料科学 · 物理学 2016-06-29 H. George E. Hentschel , Michael Moshe , Itamar Procaccia , Konrad Samwer

Notched bars of bulk metallic glasses, Pd$_{40}$Ni$_{40}$P$_{20}$ and Zr$_{52.5}$Cu$_{17.9}$Ni$_{14.6}$Al$_{10}$Ti$_{5}$, were deformed under 3-point bending conditions, resulting in the formation of shear bands before failure. The…

材料科学 · 物理学 2020-06-24 Farnaz A. Davani , Sven Hilke , Harald Rösner , David Geissler , Annett Gebert , Gerhard Wilde

The interaction of shear bands with crystalline nanoprecipitates in Cu-Zr-based metallic glasses is investigated by a combination of high-resolution TEM imaging and molecular-dynamics computer simulations. Our results reveal different…

材料科学 · 物理学 2016-05-11 Tobias Brink , Martin Peterlechner , Harald Rösner , Karsten Albe , Gerhard Wilde

Magnetic nanogels (MNG) -- soft colloids made of polymer matrix with embedded in it magnetic nanoparticles (MNPs) -- are promising magneto-controllable drug carriers. In order to develop this potential, one needs to clearly understand the…

软凝聚态物质 · 物理学 2021-11-11 Ivan S. Novikau , Ekaterina V. Novak , Elena S. Pyanzina , Sofia S. Kantorovich

Recent experiments provide evidence for density variations along shear bands (SB) in metallic glasses with a length scale of a few hundreds nanometers. Via molecular dynamics simulations of a generic binary glass model, here we show that…

软凝聚态物质 · 物理学 2019-11-13 Muhammad Hassani , Alexandra E. Lagogianni , Fathollah Varnik

The effect of small-amplitude periodic shear on annealing of a shear band in binary glasses is investigated using molecular dynamics simulations. The shear band is first introduced in stable glasses via large-amplitude periodic shear, and…

软凝聚态物质 · 物理学 2021-05-11 Nikolai V. Priezjev

The ubiquitous appearance of regions of localized deformation (shear bands) in different kinds of disordered materials under shear is studied in the context of a mesoscopic model of plasticity. The model may or may not include relaxational…

软凝聚态物质 · 物理学 2015-05-19 E. A. Jagla

The effect of periodic shear on strain localization in disordered solids is investigated using molecular dynamics simulations. We consider a binary mixture of one million atoms annealed to a low temperature with different cooling rates and…

软凝聚态物质 · 物理学 2022-09-30 Nikolai V. Priezjev

The shear modulus G of two glass-forming colloidal model systems in d=3 and d=2 dimensions is investigated by means of, respectively, molecular dynamics and Monte Carlo simulations. Comparing ensembles where either the shear strain gamma or…

软凝聚态物质 · 物理学 2015-06-12 J. P. Wittmer , H. Xu , P. Polińska , F. Weysser , J. Baschnagel

Shear band propagation and interaction are critical to the mechanical performance of metallic glasses and are strongly governed by thermal history, yet their microscopic mechanisms remain unclear. Here, using molecular dynamics simulations…

材料科学 · 物理学 2025-12-24 Lechuan Sun , Shan Zhang , Bin Xu , Rui Su , Yunjiang Wang , Pengfei Guan

We report computer simulations of oscillatory athermal quasi-static shear deformation of dense amorphous samples of a three dimensional model glass former. A dynamical transition is observed as the amplitude of the deformation is varied:…

无序系统与神经网络 · 物理学 2015-06-15 Davide Fiocco , Giuseppe Foffi , Srikanth Sastry

Quantitative density measurements from electron scattering show that shear bands in deformed Al_{88}Y_{7}Fe_{5} metallic glass exhibit alternating high and low density regions, ranging from -9 % to +6 % relative to the un-deformed matrix.…

材料科学 · 物理学 2015-12-10 Vitalij Schmidt , Harald Rösner , Martin Peterlechner , Paul M. Voyles , Gerhard Wilde

We investigate the effect of annealed disorder on the mechanical properties and plasticity of a modeled amorphous solid by introducing a small fraction of heavy impurities into the material which resembles real experimental systems. The…

软凝聚态物质 · 物理学 2024-06-19 Meenakshi L. , Bhaskar Sen Gupta
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