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If you don't get an answer, it is most likely because your question is:

   - trivial (could be found easily by searching the UG, the FAQs or the
   digest)
   - did not follow the *"Nettiquette"* defined below. A message like:
   "LAPW2 stops in FERMI - Please help me" will most likely not be answered.
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   specific task?, what is in the error and output files,... maybe we need the
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On Wed, Jan 6, 2016 at 9:25 AM, Nazia Erum <eru...@hotmail.com> wrote:

> Hello to all wien2k community,
>
>
> I am using wien2k 11.1 and want to calculate optical properties of a
> non-spin polarized perovskite compound with no spin orbit coupling and no
> inversion symmetry. I am doing following steps:
>
>  I run normal scf with 5000 k points and converge energy.
>
> After convergence I run all optic option one by one but at the end the
> file crash.
>
> Please guide me about sequence of options to run optical properties.
>
>
> thanks in advance
>



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