[Wien] ROTDEF error

[Peter Blaha]

It is due to a "user-error".

Either you neglected all warnings during initialization, or you broke symmetry
later on  (eg. doing c/a variation in a cubic structure ??)

Am 10.05.2012 10:39, schrieb AJAY SINGH VERMA:
> Daer user,
> please can you explain what is ROTDEF error and how to remove it. it occurs as below.
> LAPW0 END
> ROTDEF - Error
>
>  > stop error
> ERROR status in 2D_V-10.0_COA_-4.0
> Thanks and regards
> A.S. Verma
>
>
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-- 

                                       P.Blaha
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Peter BLAHA, Inst.f. Materials Chemistry, TU Vienna, A-1060 Vienna
Phone: +43-1-58801-165300             FAX: +43-1-58801-165982
Email: blaha at theochem.tuwien.ac.at    WWW: http://info.tuwien.ac.at/theochem/
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