[Pw_forum] assignment of spin label to electronic band

bamidele ibrahim bamideleibrahim at yahoo.com
Fri Oct 12 14:36:29 CEST 2012

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

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