[Wien] Error in LAPW1
Peter Blaha
pblaha at theochem.tuwien.ac.at
Thu May 31 14:28:12 CEST 2012
You defined the SCRATCH variable in a wrong way. It should be "./", not just "/"
correct it in your .bashrc file and logout/login again (kill w2web and restart it again).
Am 31.05.2012 14:31, schrieb Reza Mahani:
>
> Hi,
>
> I am a new user of Wien2k. I am trying to run some calculations in wien2k 11.1 but I got following error message in LAPW1 in the first cycle.
>
> 'INILPW' - can't open unit: 10
> 'INILPW' - filename: /test.vectorup
> 'INILPW' - status: unknown form: unformatted
> 'LAPW1' - INILPW aborted unsuccessfully.
>
> I tried to look for the solution in the mailing list but it was not helpful.
> However, I could run the same job in another cluster before and it did work.
> I was wondering if anybody could help me to solve this problem.
>
> Regards
> Reza
>
>
>
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> Wien at zeus.theochem.tuwien.ac.at
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--
P.Blaha
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Peter BLAHA, Inst.f. Materials Chemistry, TU Vienna, A-1060 Vienna
Phone: +43-1-58801-165300 FAX: +43-1-58801-165982
Email: blaha at theochem.tuwien.ac.at WWW: http://info.tuwien.ac.at/theochem/
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