[Wien] Extra vertical lines in bandstructure in spaghetti

[Gavin Abo]

What did you change the data toler value to?  The 1.d-07 [ 
https://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/msg15787.html 
] to 1.d-05 [ 
https://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/msg16402.html 
]?

You used bz_lin.patch [ 
https://github.com/gsabo/WIEN2k-Patches/tree/master/17.1 ] or changed 
bz_lin.f yourself (by hand)?

How did you recompile?  make clean, make, cp spaghetti .. or 
./siteconfig, R Compile/Recompile, S Select program, spaghetti?

It may be that nobody can help further without having a case.struct and 
case.klist_band to reproduce the bandstructure like last time [ 
https://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/msg15781.html 
].

On 2/19/2018 3:23 PM, Sergio Castillo Robles wrote:
> Hi dear Wien users,
>
> I would appreciate any help you could give me to solve this problem:
>
> I am running the latest version of wien2k, 17.1 in a computer with
> Processor (CPU):   Intel(R) Core(TM)2 Extreme CPU Q6850 @ 3.00GHz
> Speed:  1,998.00 MHz
> Cores:  4 RAM: 2.0 GiB
> OS:  Linux 2.6.31.14-0.8-default x86_64
> System:  openSUSE 11.2 (x86_64)
> KDE:  4.3.5 (KDE 4.3.5) "release 0"
> SUSE Linux 4.4.1 gcc-4_4-branch revision 150839
>
> The problem occurs when i plot the bandstructure in wien2k following
> the steps as the UG suggests, in the graph there are a bunch of
> vertical lines between the M and K points, and the same lines appears
> when i select the k-path with xcrysden. I have tried changing the 
> value in the bz_lin.f file as someone suggests but the issue continues.
>
> What is generating this extra lines?
>
> Thanks for your time. Best regards.