[Wien] case.inop file

Peter Blaha pblaha at theochem.tuwien.ac.at
Sat Oct 19 12:48:16 CEST 2019


This is the upper limit of k-points and used onlyfor debugging or analysis.

Leave it as it is.

Regards

Am 19.10.2019 um 12:34 schrieb Peeyush kumar kamlesh:
> Sir,
> In optical properties calculation
> I used k mesh of (21x21x21=9261). But when I edit case.inop file it 
> shows 99999 k point by default. Should I change it to 9261 or it is ok 
> with the default points?
> 
> Regards
> 
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