What did you change the data toler value to? The 1.d-07 [
] to 1.d-05 [
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 [
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 18.104.22.168-0.8-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.
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