The WIEN2k updates page [1] has:
*VERSION_21: 10.4.2021 *
...
**• *SRC_spaghetti:* bz_lin.f: consistent use of toler (fixing
additional black lines)
Have you tried WIEN2k 21.1 having the above band structure black lines fix?
You might also have to be careful with the band structure commands with
there being differences for the SOC case [2,3].
[1] http://www.wien2k.at/reg_user/updates/
[2]
https://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/msg13143.html
[3]
https://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/msg12338.html
On 5/9/2022 4:41 PM, delamora wrote:
Dear Wien community,
I am doing a calculation with SOC, and when I try to plot the band
structure without SOC
spaghetti -p -up
it looks fine
but when I put it with SOC
spaghetti -p -up -so
I get a bandstructure with many vertical lines
Is there a way to fix it?
(WIEN2k-19.1)
Thanks
Pablo
===============
I sent a message with a bandstructure, and it was too big
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