[Wien] (no subject)

[Peter Blaha]

What errors ???

I just tried it and it works.

For spin-pol. case You may have to copy case.outputso to case.output1up

On 06/22/2016 07:23 PM, Jyoti Krishna wrote:
> Hello Prof. Blaha ,
>
> Could you please suggest me that in Wien2k, how can I get Fermi surface plot in Xcrysden by taking spin-orbit (SO) and ORB into consideration?
>
> As read from the previous archives, I had done Fermi surface plot for GGA+U+SO  by  first doing cp case.outputso case.output1 .
> But, its still showing erroneous results. Is there any other method?
>
> Thanks
>
> Jyoti Krishna
> Research Scholar
> Department of Physics
> Indian Institute of Technology Roorkee,
> Roorkee,
> Uttrakhand.
>
>
>
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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    WIEN2k: http://www.wien2k.at
WWW:   http://www.imc.tuwien.ac.at/staff/tc_group_e.php
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