[QE-users] Interested in difficult to converge systems

John McFarland jm18ec at my.fsu.edu
Thu Jul 30 19:12:55 CEST 2020


Dear all,

I'm interested in systems where SCF has trouble converging to self consistency and instead keeps fluctuating. In particular I would really like any input files of such systems.

Best Regards,
John McFarland
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20200730/61ca4f2a/attachment.html>


More information about the users mailing list