[Wien] shifteig in wien2wannier

Elias Assmann elias.assmann at gmail.com
Wed Jan 4 15:59:23 CET 2017


On 01/03/2017 04:35 AM, Koyel Bandopadhyay wrote:
> When do we need to do shifteig?
> Is it done before/after w2w step?

Normally (when you have a correct Fermi energy), you do not need it at all.

If you need to use it, it is between w2w and wannier90, since it acts on
case.eig.  If you want to adapt the Fermi energy before w2w, you can do
so by editing case.fermi.


	Elias



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