[Wien] 'LOPW' - Plane waves exhausted
Volodymyr Svitlyk
svitlyk at esrf.fr
Mon Feb 21 21:56:20 CET 2011
Hi all,
I have tried to use my custom klist. I have copied my klist into the
directory, set TEMP as a Fermi-method with eval = 0.002, then I just
skipped the kgen command during the initialize calc.
<http://coral33.esrf.fr:7891/exec/initlapw.pl?SID=195473>At the lapw1 I
got the error "'LOPW' - Plane waves exhausted."
I guess something is wrong in the way I feed the klist?
Thank you.
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/20110221/91c58f9c/attachment.htm>
More information about the Wien
mailing list