[Wien] coordinate system

[Peter Blaha]

It is in the "local" coordinate system.

Check case.struct (or case.outputs).
If the local rotation matrix is the unit matrix, it is in the global
crystalline coordinate system. (For low symmetry cases, check the UG
for the definition).

Am 23.01.2011 06:22, schrieb YONGBIN LEE:
> Dear Wien Users
> Could you tell me which coordinate system is used for *.vorbup(dn) and *.dmatup(dn) file?
> I'm trying to understand *.dmatup(dn), *.vorbup(dn) file for 4f states.
>
> Best,
> Chang
>
>
>
>
> _______________________________________________
> Wien mailing list
> Wien at zeus.theochem.tuwien.ac.at
> http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien

-- 
-----------------------------------------
Peter Blaha
Inst. Materials Chemistry, TU Vienna
Getreidemarkt 9, A-1060 Vienna, Austria
Tel: +43-1-5880115671
Fax: +43-1-5880115698
email: pblaha at theochem.tuwien.ac.at
-----------------------------------------