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research article

Plastic activity in nanoscratch molecular dynamics simulations of pure aluminium

Junge, Till  
•
Molinari, Jean-Francois  
2014
International Journal Of Plasticity

Atomistic models for friction suffer from the severe length- and time-scale restrictions of molecular dynamics. In this paper, a novel approach to quantify the scratching work and the energy associated with plastic activity is used. The approach is combined with a statistical criterion to determine the significance of simulation box size, microstructure and sliding rate effects on the friction coefficient. This method is applied to a large parametric molecular dynamics study of single-asperity nanoscratch on monocrystalline and polycrystalline aluminium substrates. The results show that even though simulation size affects the plastic core mechanisms of sliding friction, the method overcomes size dependence when it comes to the predicted value of the friction coefficient. We show that friction in monocrystalline and polycrystalline substrates activates very different mechanisms and describe them in some detail for the polycrystalline case. Furthermore, we show that even when the friction coefficient appears to be size independent over a range of simulation box sizes, the plastic activity associated with it remains non-monotonically size dependent. (C) 2013 Elsevier Ltd. All rights reserved.

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Type
research article
DOI
10.1016/j.ijplas.2013.07.005
Web of Science ID

WOS:000331494700006

Author(s)
Junge, Till  
Molinari, Jean-Francois  
Date Issued

2014

Publisher

Pergamon-Elsevier Science Ltd

Published in
International Journal Of Plasticity
Volume

53

Start page

90

End page

106

Subjects

Friction

•

Dislocations

•

Plasticity

•

Molecular dynamics

Editorial or Peer reviewed

REVIEWED

Written at

EPFL

EPFL units
LSMS  
Available on Infoscience
April 2, 2014
Use this identifier to reference this record
https://infoscience.epfl.ch/handle/20.500.14299/102425
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