[Pw_forum] ecutwfc

[Sohail Ahmad]

Dear Users,
In QE, the usual first step is testing PP and ecutwfc
I did it the same for bulk structure of a compound and followed further calculations

 May i consider the same value of ecutoff for mono or bilayers of the same compound as i am considering the same pseudo potential

This testing is required for pp or for structure

Sohail
KKU
Saudi
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20120716/23d8c881/attachment.html>