[Pw_forum] (no subject)

ramzi alaya ramzialaya at hotmail.fr
Fri Aug 24 15:42:50 CEST 2012


Dear all:

I will study the structural properties of zinc blende ternary alloys. The calculation will be performed on a supercell 16 atoms (1 * 1 * 2). My question is as follows:
How do I define my input parameters (ibrav, celldm).

Thank you.Regards.




****************************************************************************************************************************************************************************
Ramzi Alaya
E-mail : ramzialaya at hotmail.fr
Faculté des Sciences de Gabès, Cité Erriadh 6072 Gabès- Tunisie
Unité de Recherche sur les Hétéro-Epitaxies et Applications


 		 	   		  
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20120824/91911dfc/attachment.html>


More information about the users mailing list