[CP2K-user] SCF_GUESS: using restart with atomic guess for additional atoms

Fabian Ducry fabia... at gmail.com
Tue Feb 4 20:34:05 UTC 2020


Thanks for the answer! How can I file an enhancement request?

I could possibly hack something together to work for my specific case. But 
from looking at the source code I doubt I could implement this in a nice 
way.

Fabian
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <https://lists.cp2k.org/archives/cp2k-user/attachments/20200204/06e6f2ad/attachment.html>


More information about the CP2K-user mailing list