[DFTB-Plus-User] Question about dptools

Bálint Aradi aradi at uni-bremen.de
Mon Jun 12 14:55:11 CEST 2023


Dear Mehrdad,

do you use the most recent version of dptools and dftb+? If yes, please 
make a bug report on GitHub:

https://github.com/dftbplus/dftbplus/issues

Also, please note, that there is no support team for dftb+. We answer 
user questions on an absolutely voluntarily basis by sparing some of our 
research time for helping others with their dftb+ related problems. ;-)

Best regards,

Bálint


On 08.06.23 01:17, mehrdad shiri via DFTB-Plus-User wrote:
> Dear support team
> When I am using the dp_bands command from dp_tools module it always 
> gives an error of " nkpt = len(eigvalarrays) / nspin ZeroDivisionError: 
> integer division or modulo by zero"
> 
> It seems that the parameters are not being extracted correctly from 
> band.out file. how can I fix this issue?
> 
> Best
> 
> Mehrdad
> 
> _______________________________________________
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> DFTB-Plus-User at mailman.zfn.uni-bremen.de
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-- 
Dr. Bálint Aradi
Bremen Center for Computational Materials Science, University of Bremen
http://www.bccms.uni-bremen.de/cms/people/b-aradi/


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