Repository logo

Infoscience

  • English
  • French
Log In
Logo EPFL, École polytechnique fédérale de Lausanne

Infoscience

  • English
  • French
Log In
  1. Home
  2. Academic and Research Output
  3. Journal articles
  4. Sliding mechanisms in aluminum grain boundaries
 
research article

Sliding mechanisms in aluminum grain boundaries

Molteni, C.
•
Marzari, N.  
•
Payne, M. C.
Show more
1997
Physical Review Letters

We present a detailed investigation, based on ensemble density functional theory simulations, of the microscopic mechanisms that accompany the sliding of grain boundaries in aluminum, a typical ductile metal. We find a variety of sliding behaviors, including coupling to migration, that depend not only on the delocalized character of the metallic bonding, but also on the boundary geometry, the local order, and the presence of defects. While our previous results showed that sliding in germanium is controlled by local stick-slip events involving rebonding of a few atoms, we find that in aluminum larger numbers of atoms act in concert over extended areas, ultimately limited by boundary defects.

  • Details
  • Metrics
Type
research article
DOI
10.1103/PhysRevLett.79.869
Author(s)
Molteni, C.
Marzari, N.  
Payne, M. C.
Heine, V.
Date Issued

1997

Published in
Physical Review Letters
Volume

79

Issue

5

Start page

869

End page

872

Subjects

molecular-dynamics

•

metals

Editorial or Peer reviewed

REVIEWED

Written at

OTHER

EPFL units
THEOS  
Available on Infoscience
June 29, 2012
Use this identifier to reference this record
https://infoscience.epfl.ch/handle/20.500.14299/82988
Logo EPFL, École polytechnique fédérale de Lausanne
  • Contact
  • infoscience@epfl.ch

  • Follow us on Facebook
  • Follow us on Instagram
  • Follow us on LinkedIn
  • Follow us on X
  • Follow us on Youtube
AccessibilityLegal noticePrivacy policyCookie settingsEnd User AgreementGet helpFeedback

Infoscience is a service managed and provided by the Library and IT Services of EPFL. © EPFL, tous droits réservés