Plasticity of Cu nanoparticles: Dislocation-dendrite-induced strain hardening and a limit for displacive plasticity

The plastic behaviour of individual Cu crystallites under nanoextrusion is studied by molecular dynamics simulations. Single-crystal Cu fcc nanoparticles are embedded in a spherical force field mimicking the effect of a contracting carbon shell, inducing pressure on the system in the range of gigapa...

Full description

Bibliographic Details
Main Authors: Antti Tolvanen, Karsten Albe
Format: Article
Language:English
Published: Beilstein-Institut 2013-03-01
Series:Beilstein Journal of Nanotechnology
Subjects:
Online Access:https://doi.org/10.3762/bjnano.4.17
_version_ 1828427465425420288
author Antti Tolvanen
Karsten Albe
author_facet Antti Tolvanen
Karsten Albe
author_sort Antti Tolvanen
collection DOAJ
description The plastic behaviour of individual Cu crystallites under nanoextrusion is studied by molecular dynamics simulations. Single-crystal Cu fcc nanoparticles are embedded in a spherical force field mimicking the effect of a contracting carbon shell, inducing pressure on the system in the range of gigapascals. The material is extruded from a hole of 1.1–1.6 nm radius under athermal conditions. Simultaneous nucleation of partial dislocations at the extrusion orifice leads to the formation of dislocation dendrites in the particle causing strain hardening and high flow stress of the material. As the extrusion orifice radius is reduced below 1.3 Å we observe a transition from displacive plasticity to solid-state amorphisation.
first_indexed 2024-12-10T17:02:11Z
format Article
id doaj.art-33c5b745fa4d4a02b67732f10d6d89d6
institution Directory Open Access Journal
issn 2190-4286
language English
last_indexed 2024-12-10T17:02:11Z
publishDate 2013-03-01
publisher Beilstein-Institut
record_format Article
series Beilstein Journal of Nanotechnology
spelling doaj.art-33c5b745fa4d4a02b67732f10d6d89d62022-12-22T01:40:32ZengBeilstein-InstitutBeilstein Journal of Nanotechnology2190-42862013-03-014117317910.3762/bjnano.4.172190-4286-4-17Plasticity of Cu nanoparticles: Dislocation-dendrite-induced strain hardening and a limit for displacive plasticityAntti Tolvanen0Karsten Albe1Technische Universität Darmstadt, Institut für Materialwissenschaft, Fachgebiet Materialmodellierung, Petersenstr. 32, 64287 Darmstadt, GermanyTechnische Universität Darmstadt, Institut für Materialwissenschaft, Fachgebiet Materialmodellierung, Petersenstr. 32, 64287 Darmstadt, GermanyThe plastic behaviour of individual Cu crystallites under nanoextrusion is studied by molecular dynamics simulations. Single-crystal Cu fcc nanoparticles are embedded in a spherical force field mimicking the effect of a contracting carbon shell, inducing pressure on the system in the range of gigapascals. The material is extruded from a hole of 1.1–1.6 nm radius under athermal conditions. Simultaneous nucleation of partial dislocations at the extrusion orifice leads to the formation of dislocation dendrites in the particle causing strain hardening and high flow stress of the material. As the extrusion orifice radius is reduced below 1.3 Å we observe a transition from displacive plasticity to solid-state amorphisation.https://doi.org/10.3762/bjnano.4.17dislocation interactionsmechanical propertiesmolecular dynamicsnanoparticlesimulation
spellingShingle Antti Tolvanen
Karsten Albe
Plasticity of Cu nanoparticles: Dislocation-dendrite-induced strain hardening and a limit for displacive plasticity
Beilstein Journal of Nanotechnology
dislocation interactions
mechanical properties
molecular dynamics
nanoparticle
simulation
title Plasticity of Cu nanoparticles: Dislocation-dendrite-induced strain hardening and a limit for displacive plasticity
title_full Plasticity of Cu nanoparticles: Dislocation-dendrite-induced strain hardening and a limit for displacive plasticity
title_fullStr Plasticity of Cu nanoparticles: Dislocation-dendrite-induced strain hardening and a limit for displacive plasticity
title_full_unstemmed Plasticity of Cu nanoparticles: Dislocation-dendrite-induced strain hardening and a limit for displacive plasticity
title_short Plasticity of Cu nanoparticles: Dislocation-dendrite-induced strain hardening and a limit for displacive plasticity
title_sort plasticity of cu nanoparticles dislocation dendrite induced strain hardening and a limit for displacive plasticity
topic dislocation interactions
mechanical properties
molecular dynamics
nanoparticle
simulation
url https://doi.org/10.3762/bjnano.4.17
work_keys_str_mv AT anttitolvanen plasticityofcunanoparticlesdislocationdendriteinducedstrainhardeningandalimitfordisplaciveplasticity
AT karstenalbe plasticityofcunanoparticlesdislocationdendriteinducedstrainhardeningandalimitfordisplaciveplasticity