[xcrysden] Runtime error in rendering the Fermi surface

lung Fermin ferminlung at gmail.com
Thu Dec 10 04:53:22 CET 2015


Thanks Dr. Kroeker and Prof. Blaha for the comments.


>
> What do you mean by:
>  > 1. generating the kmesh in xcrysden    ???
>
> If it is the first point in the FS generation, this is fine.
> But it must not be the special k-path along high-symmetry directions
> used for bandstructures, which can also be done by xcrysden.
>
> Yep. I did mean the first point in the FS generation.

Regards,
Fermin
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