[Wien] mixer error

2011-03-30 Thread shamik chakrabarti
Dear wien2k users,

   We were running a SCF on A2BC type materials.
After few iterations it got stopped by showing an error *mixer.def failed*.
In the corresponding error file it was written that "*error in mixer*". We
have created a fresh directory and run a fresh SCF again but it got stopped
again with the same error message. We are not able to move any further then.
In this regard any response will be very fruitful to us. Thanking you,

with best regards,

-- 
Shamik Chakrabarti
Research Scholar
Dept. of Physics & Meteorology
Material Processing & Solid State Ionics Lab
IIT Kharagpur
Kharagpur 721302
INDIA
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[Wien] mixer error

2011-03-30 Thread Laurence Marks
1. Look in case.dayfile for information
2. Look in :log for information
3. Look in case.outputm for information
4. Look in case.scfm for information

We can only point you in the direction to look for information.

2011/3/29 shamik chakrabarti :
> Dear wien2k users,
> ?? ? ? ? ? ? ? ? ? ? ? ? ? We were running a SCF on A2BC type materials.
> After few iterations it got stopped by showing an error mixer.def failed. In
> the corresponding error file it was written that "error in mixer". We have
> created a fresh directory and run a fresh SCF again but it got stopped again
> with the same error message. We are not able to move any further then. In
> this regard any response will be very fruitful to us. Thanking you,
> with best regards,
>
> --
> Shamik Chakrabarti
> Research Scholar
> Dept. of Physics & Meteorology
> Material Processing & Solid State Ionics Lab
> IIT Kharagpur
> Kharagpur 721302
> INDIA
>
> ___
> Wien mailing list
> Wien at zeus.theochem.tuwien.ac.at
> http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien
>
>



-- 
Laurence Marks
Department of Materials Science and Engineering
MSE Rm 2036 Cook Hall
2220 N Campus Drive
Northwestern University
Evanston, IL 60208, USA
Tel: (847) 491-3996 Fax: (847) 491-7820
email: L-marks at northwestern dot edu
Web: www.numis.northwestern.edu
Chair, Commission on Electron Crystallography of IUCR
www.numis.northwestern.edu/
Electron crystallography is the branch of science that uses electron
scattering and imaging to study the structure of matter.