[Pw_forum] assignment of spin label to electronic band

[bamidele ibrahim]

Dear Pal,
 It is possible. What you need to do is to set the filag 

spin_component=1or 2. in the bands extraction. 

1= up amd 2=down spin respectively.

Hope this help.


 
---------------------------------------------------------------------------------------------------
Adetunji Bamidele Ibrahim(PhD Student)
Department of physics,University of Agriculture,
Abeokuta, Ogun State,Nigeria.
---------------------------------------------------------------------------------------------------



________________________________
 From: koushik pal <koushik.pal.physics at gmail.com>
To: pw_forum at pwscf.org 
Sent: Friday, October 12, 2012 12:46 PM
Subject: [Pw_forum] assignment of spin label to electronic band
 

Dear PW users,
 Is it possible to assign spin label to the electronic bands? That means, can we tell which band is associated with up spin and which one due to down spin? If possible, can somebody please tell me how to do that?
 P.S.- I'm doing fully relativistic calculation with spin-orbit coupling.

Thanks in advance,
Koushik Pal
MS student
JNCASR, Bangalore, India

-- 

Koushik Pal
Materials Theory Group
Int PhD student
JNCASR
CPMU



_______________________________________________
Pw_forum mailing list
Pw_forum at pwscf.org
http://pwscf.org/mailman/listinfo/pw_forum
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20121012/30c704f8/attachment.html>