[Wien] afminput ???????

[Peter Blaha]

I can't say where the problem is.

Make sure you have: Case.struct_supergroup  and not  case.struct_super group

You should also update to a new WIEN2k version. Questions for WIEN2k_5 are
often completely outdated.

>   I'm using the Wien2k_5 version compiled with gfortran. I made struct
> file and struct_supergroup too for Cr as mentioned in user guide, I
> edit Case.inst and run afminput, but  it didn't   execute  and I
> encounter by this error " afminput need input "  whereas I construct
> case.struct_super group Why doesn't  afminput  know this file? and
> what about afminput.def as you see in following ?
> any suggestion
>
>
> 14, 'CaseAFM.outputafminput',  'unknown','formatted', 0
> 15, 'CaseAFM.inclmcopy_st',    'unknown','formatted', 0
> 16,'CaseAFM.clmup',            'old',    'formatted', 0
> 17,'CaseAFM.clmdn',            'old',    'formatted', 0
> 20,'CaseAFM.struct',           'old',    'formatted', 0
> 21,'Case.struct_supergroup','unknown','formatted', 0
>
> Regards
> Dorna Forough
> _______________________________________________
> Wien mailing list
> Wien at zeus.theochem.tuwien.ac.at
> http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien

-- 

                                       P.Blaha
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Peter BLAHA, Inst.f. Materials Chemistry, TU Vienna, A-1060 Vienna
Phone: +43-1-58801-15671             FAX: +43-1-58801-15698
Email: blaha at theochem.tuwien.ac.at    WWW: http://info.tuwien.ac.at/theochem/
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