[Wien] WIEN2K_4.10- no orb option in run_lapw

[Peter Blaha]

>                 Recently I downloaded the latest version (WIEN2K_4.10)and 
> expanded and compiled in a new directory. There was a mail that with this 
> version it is possible to do LDA+U calculations without doing spin polarised 
> calculations i.e.
>                  ./run_lapw -orb is possible.
> But when I am trying to run this it is saying that -orb option is not possible.

You always need a "spin-polarized setup" for LDA+U. However, to obtain
a nonmagnetic solution you may use:

runsp_c -orb

                                      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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