[Wien] mixer error with gfortran

[Laurence Marks]

Normally this means that one of the other programs (lapwso, lapw2 etc)
crashed. Please check the *.error files & *.dayfile

---
Professor Laurence Marks
"Research is to see what everybody else has seen, and to think what nobody
else has thought", Albert Szent-Gyorgi
http://www.numis.northwestern.edu
Corrosion in 4D http://MURI4D.numis.northwestern.edu
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Co-Editor, Acta Cryst A


On Oct 4, 2017 06:36, "Md. Fhokrul Islam" <fislam at hotmail.com> wrote:

> Hi Wien2k users,
>
>
> I am trying to do TiC calculation as mentioned in the userguide with
> Wien2k compiled with gfortran.
>
> It works fine without spin-orbit (SO) coupling but if I add SO it crashes
> in the 1st cycle with 'mixer error'.
>
>
> error: command   /bionano2/Wien2k14.2/mixer mixer.def   failed
>
>
> There is no other error message or error file. However, if I do the same
> TiC calculation in another
>
> machine with an intel compiled Wien2k, this problem does not arise. So I
> am not sure why there
>
> is a mixer error with gfortran for TiC when I do spin-orbit calculation.
>
>
> I tried another test calculation with GaAs but this one works fine with
> gfortran.
>
>
> Any suggestion will be appreciated.
>
>
>
> Thanks,
>
> Fhokrul
>
>
>
>
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