[Wien] Electronic Structure of CoP3

[Banaras Khan]

Dear WIEN2k Members

I am working on CoP3 skutterudute compound and tried to get the electronic
structure by minimizing the internal parameters.

Bandgap is clearly seen in density of states and from the grep command
but the Bandgap is not there in the Electronic Band

Structure. Please guide me..

   Thanks

   Banaras Khan
   University of Malakand, Chakdara, Pakistan.
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/20131231/2fb05630/attachment.htm>