[Wien] PGFIO!!
Peter Blaha
pblaha at zeus.theochem.tuwien.ac.at
Mon Jun 30 09:04:32 CEST 2003
> In addition, I found the "***********" occured in the case.vnsdn instead of the data .
I do not quite understand how you could run lapw1 without error,
but have a crash in lcore ?
case.vnsdn should not have been modified in between.
Anyway, rerun x lapw0 which should create a new vnsup/dn file. Check if
the ****** are gone.
If not, the problem is already in the clmsum file. Check this too!!
Or try copying clmsum_old to clmsum and x lapw0.
After those "tricks", do not forget to remove *.broy*
Regards
P.Blaha
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Peter BLAHA, Inst.f. Materials Chemistry, TU Vienna, A-1060 Vienna
Phone: +43-1-58801-15671 FAX: +43-1-58801-15698
Email: blaha at theochem.tuwien.ac.at WWW: http://info.tuwien.ac.at/theochem/
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