[Wien] Fwd: Error while parallel run
alpa dashora
dashoralpa at gmail.com
Mon Jul 30 09:21:00 CEST 2012
Dear Prof. Blaha,
As per your suggestion, I am able to run the k-point parallel calculation.
But in case of large systems, about 100 atoms, can I use this technique
(with how many k-points?)?
rgds,
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/20120730/3f9e44f5/attachment.htm>
More information about the Wien
mailing list