[Wien] Extra vertical lines in bandstructure in spaghetti

[Gavin Abo]

Thanks Prof. Blaha.  I tried it on my test case, andthe lines only 
appear on the M, K, and GAMMA points now. So, it seems to work fine 
now.  The case.bands.agr plot does not show SIGMA like the 
case.spaghetti_ps does.  However, I can manually add the SIGMA (or other 
special labels) in xmgrace to my case.bands.agr plot, if I want them.

[ 
https://github.com/gsabo/WIEN2k-Patches/blob/master/17.1/SrPtAs_bandstructure_vlines_patched.pdf 
]

On 2/28/2018 1:52 AM, Peter Blaha wrote:
> I've changed bz_lin.f  in SRC_spaghetti and it seems to solve the 
> problem. Please try it.
>
> Regards
>
> On 02/23/2018 10:42 PM, Sergio Castillo Robles wrote:
>> Hi, thank you for your response,
>>
>> I changed the data toler value from 1.d-07 to 1.d-05 by myself, and 
>> recompiled with ./siteconfig, R Compile/Recompile, S Select program, 
>> spaghetti
>>
>> but the problem still persist.
>>
>> Who should i send the files to?
>>
>> Thanks for your answer and your time
>>
>> Regards
>>
>>
>> 2018-02-19 20:29 GMT-08:00 Gavin Abo <gsabo at crimson.ua.edu 
>> <mailto:gsabo at crimson.ua.edu>>:
>>
>>     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
>> <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
>> <https://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/msg16402.html>
>>     ]?
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/20180304/c2eda67a/attachment.html>