First principles study of Al(100) twisted interfaces
|Robert Sot 1,2, Jacek Piechota 2|
1. Warsaw University of Technology, Faculty of Materials Science and Engineering (InMat), Wołoska 141, Warszawa 02-507, Poland
The first principles density functional calculations have been performed for a number of Al(100) twisted interfaces with the purpose to investigate the most stable atomic structures. Orientation dependence of interface energy normalized to bulk is established and discussed. The obtained results can be used to model grain growth in molecular dynamics studies.
Presentation: Poster at E-MRS Fall Meeting 2006, Symposium H, by Jacek Piechota
See On-line Journal of E-MRS Fall Meeting 2006
Submitted: 2006-05-15 19:54 Revised: 2009-06-07 00:44
|© 1998-2021 pielaszek research, all rights reserved||Powered by the Conference Engine|