[Wien] BoltzTraP

[emami seyyed amir abbas]

 Dear users


I am trying to obtain transport properties of a magnetic material by BoltZtrap. In case.intrans need to specify the valence electron.
Now in spin polarize calculation, the valence electron must split to up and dn or the total valence electron must insert.


thanks. 

-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/20151126/553776d4/attachment.html>