[Pw_forum] Problem with charged defect calculation

[Mostafa Youssef]

Dear Evan,

The postprocessing utility pp.x can calculate and plot the average potential as a function of x or y or z. This can help in performing the potential alignment.



Regards
Mostafa Youssef
MIT

-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20160906/c9da47e1/attachment.html>