[Wien] w2web fat band plortting does not work with limited energy range in case.inq

[Lyudmila Dobysheva]

26.03.2023 15:52, pluto via Wien wrote:
> To limit the size of the case.qtl I often limit the energy range and the 
> printed atoms in case.inq. For example, out of many atoms I only use 2 
> atoms, and I set the -1 to 1 range:
> 
> -1.0   1.0           Emin  Emax
>     2                 number of atoms
>     3   1  0  1       iatom,qsplit,symmetrize,locrot
> 3   0  1  2          nL, l-values
> 0 0 1
>     4   1  0  1       iatom,qsplit,symmetrize,locrot
> 3   0  1  2          nL, l-values
> 0 0 1
I'd say that 0 0 1 line (new axis z) should be only once:

-1.0   1.0           Emin  Emax
    2                 number of atoms
    3   1  0  1       iatom,qsplit,symmetrize,locrot
3   0  1  2          nL, l-values
    4   1  0  1       iatom,qsplit,symmetrize,locrot
3   0  1  2          nL, l-values
0 0 1

Best wishes
Lyudmila Dobysheva
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