[Wien] error with lapwdmpara
Peter Blaha
pblaha at theochem.tuwien.ac.at
Thu Apr 6 16:12:47 CEST 2006
Hi,
I can confirm this problem in version WIEN2k_6.2
I introduced this with the last update to work against the NFS-problem.
To fix it pleas edit lapw2para_lapw
Locate the lines:
# fix for NFS bug:
touch $case.weight
rm $case.weigh*
and replace the "rm line" by:
rm $case.weigh${updn}_* $case.clmval${updn}_* $case.vrespval${updn}_* $case.help${updn}_* $case.scf2${updn}_*
(Afterwards you have to rerun lapw2 -p -up/dn)
Regards
> Here is the errors when I type x lapwdm -up -p (version 6.2).
>
> Regards,
> Khuong
>
> running LAPWDM in parallel mode
> [1] 17997
> forrtl: severe (24): end-of-file during read, unit 26, file
> /HOME01/mic/cc0406/CuexLDA/CuexLDA.weighup_1
P.Blaha
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