[Wien] QTL for triclinic

[Peter Blaha]

Dear Florent,

Yes, your fix seems logical. Previously also in a triclinic case it would run into
the monoclinic-gamma section.

Thanks.

Am 16.06.2012 13:10, schrieb Florent Boucher:
> Dear Peter
> I had to modified a little the angle.f in SRC_qtl to have it working correctly for triclinic cases.
> It seems to work now for oriented PDOS (the only thing I have tested).
> Best regards
> Florent
>
>
>
> _______________________________________________
> Wien mailing list
> Wien at zeus.theochem.tuwien.ac.at
> http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien
>

-- 

                                       P.Blaha
--------------------------------------------------------------------------
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/
--------------------------------------------------------------------------