[Wien] LAPW2 END - Mixer ROTDEF

[Laurence Marks]

I suggest doing "x patchsymm" and checking that the positions and symmetry
operations are right first.  This sounds like a user setup error, but I am
guessing based upon incomplete data.

---------------------------
Professor Laurence Marks
Department of Materials Science and Engineering
Northwestern University
www.numis.northwestern.edu 1-847-491-3996
"Research is to see what everybody else has seen, and to think what nobody
else has thought"
Albert Szent-Gyorgi
 On Oct 22, 2012 8:39 PM, "Gavin Abo" <gsabo at crimson.ua.edu> wrote:

>  Dear list,
>
> The full output that I got from Mohamed:
> -----------------------------
> $ runsp_lapw
> hup: Command not found.
>  LAPW0 END
>  LAPW1 END
>  LAPW1 END
>  LAPW2 END
>  LAPW2 END
>  CORE  END
>  CORE  END
> ROTDEF - Error
>
> >   stop error
> -----------------------------
>
> The terminal command:
>
> cat $WIENROOT/VERSION
>
> will most likely return
>
> Wien2k 11.1 (Release 5/4/2011)
>
> According to the past post:
>
> http://zeus.theochem.tuwien.ac.at/pipermail/wien/2011-May/014706.html
>
> I believe the mixer (latgen.f) called the ROTDEF subroutine.
>
> It seems that the mixer was updated in Wien2k 11.1 (Release 14/6/2011), so
> upgrading to a newer Wien2k version should resolve the error.
>
> On 10/22/2012 11:52 AM, Mohamed ouaissa wrote:
>
>  Dear wien2k users,
>  for more informations i calculate spinpolarized of NiFe2O4
> ferrimagnetic when i wrote my command runsp_lapw  he run normaly but
> stopped at LAPW2 END.
>  Im using wien2k_11.
>  Thanks in advance for your response
>
>   ------------------------------
> *De :* Lyudmila Dobysheva <lyuka17 at mail.ru> <lyuka17 at mail.ru>
> *À :* A Mailing list for WIEN2k users <wien at zeus.theochem.tuwien.ac.at><wien at zeus.theochem.tuwien.ac.at>
> *Envoyé le :* Lundi 22 octobre 2012 14h46
> *Objet :* Re: [Wien] LAPW2 END
>
> 21.10.2012 15:02, Mohamed ouaissa пишет:
> > when i start runsp_lapw it stops after LAPW2 as it shown below:
> > hup: Command not found.
> >  LAPW0 END
> >  LAPW1 END
> >  LAPW1 END
> >  LAPW2 END
> > who can tell me what i should do or where i did a mistake?
>
> Nobody can.
> There is no information in your letter.
>
> Best wishes
>   Lyudmila Dobysheva
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