[Wien] Gama point

Tarek Hammad hammad_tarek at hotmail.com
Wed Mar 31 01:23:26 CEST 2021


Dear wien2k team and users

Concerning computations with insulators and semiconductors with for 
instance 40 atoms or more:

How can I intentionally, choose Gama k-point ?

I tried the following and I would like to check it with you;

x kgen

number of k-points = 1

shift k-mesh "no"

for the three division fields therein, I leave them blank !!!

I hope you help me.

Thanks a lot in advance

Tarek Hammad.



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