[xcrysden] Fermi surface plot

Tone Kokalj xcrysden@democritos.it
Fri, 30 Mar 2007 18:22:02 +0200


On Wed, 2007-03-28 at 09:42 +0900, Munetaka (TAGUCHI) wrote:
> Dear XCrysDen Users:
>  
>  
> I am new user of XCrysDen.
> I am trying to plot a Fermi surface for Transition metal oxides (spin
> polarized case) 
> by using Visualization of Fermi surface for WIEN2k. 
>  
> To start this option, I choose WIEN2k case directory and 
> I am having this error.
>  
> argument to math function didn't have numeric value
> argument to math function didn't have numeric value
>     while executing
> "if { $wn(fs_nkp) != int($wn(fs_nkp)) } {
>      set wn(fs_nkp) 2000
>  }"

Apparently, xcrysden cannot figure out what is the number of k-points.
Can you send me your case.klist file (possibly also struct file). I'll
try to check what is going on.

Regards, Tone