[Wien] wien2k 08 version troubles

Peter Blaha pblaha at theochem.tuwien.ac.at
Thu May 8 11:10:21 CEST 2008


You specified a wrong   SCRATCH variable during "userconfig".
Check in uplapw1.def (or lapw1.def) the line with   ...vector
It has an illegal path.
Edit your .bashrc /.cshrc  file and set it properly  ( probably to  ./
and not to   /  )

Igor Djerdj schrieb:
> Dear all,
> Recently we installed the 08 version of Wien2k. The problems after 
> compilation without errors appeared: When I runsp_lapw-so then when 
> lapw2-c-up-so step is going to be executed there is so called 
> segmentation fault error. Secondly, when I run sp-lapw using w2web, then 
> immediately after lapw0 step the execution stopped with the messages:
> INILPW-cant open unit 10
> INILPW filename:/ NdOH3orb5.vectorup
> INILPW status unknown   form: unformatted
> LAPW1-INILPW aborted unsuccessfully.
>  
> Any help is highly appreciated.
> Igor
>  
> 
> 
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-- 

                                       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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