[Pw_forum] virtual crystal approximation

Federico Iori federico.iori at u-psud.fr
Thu Dec 8 16:52:07 CET 2016


I am not an expert of VCA, but if you google it as, "virtual crystal approximation quantum espresso" for example, I presume you can find some clues at least. 

Hope this helps. 


Federico IORI 
Marie Curie Fellow 
Laboratoire de Physique des Solides 
Bâtiment 510 - Rue André Rivière 
91400 Orsay 

----- Mensaje original -----

De: "Abdullah N. Albarakati" <anbarakati at uqu.edu.sa> 
Para: "PWSCF Forum ‎[pw_forum at pwscf.org]‎" <pw_forum at pwscf.org> 
Enviados: Jueves, 8 de Diciembre 2016 16:13:06 
Asunto: [Pw_forum] virtual crystal approximation 

Dear QE experts, 

Can we use virtual crystal approximation method with Quantum Espresso codes (pw.x)? 

If yes, How? 

Thank you in advance 

Dr. Abdullah 
Umm Al-Qura University 
Saudi Arabia 

This email and any files transmitted with it are confidential and intended solely for the use of the individual or entity to whom they are addressed. If you have received this email in error please notify Email System Administrator (e_admin at uqu.edu.sa ) . Please note that any views or opinions presented in this email are solely those of the author and do not necessarily represent those of the Umm Al-Qura University. Finally, the recipient should check this email and any attachments for the presence of viruses. The Information Technology and Technical Support Center of Umm Al-Qura University accepts no liability for any damage caused by any virus transmitted by this email. 

Pw_forum mailing list 
Pw_forum at pwscf.org 

-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20161208/0d1f0284/attachment.html>

More information about the users mailing list