[Pw_forum] bent system

ali kazempoor kazempoor2000 at yahoo.com
Thu Sep 18 18:37:45 CEST 2008


Dear all
 Is there (in dft codes like espresso) any method like supercell method to simulate bent system like nanobelt(bent one dimensional system)?
or it must be  used from  non-periodic condition (open boundary condition)?
thanks
Ali kazempour,Isfahan university of technology,Isfahan, Iran 


      
-------------- next part --------------
An HTML attachment was scrubbed...
URL: http://www.democritos.it/pipermail/pw_forum/attachments/20080918/a04629ce/attachment.htm 


More information about the Pw_forum mailing list