[DFTB-Plus-User] DFTB-Plus-User Digest, Vol 67, Issue 7

Bálint Aradi aradi at uni-bremen.de
Thu Mar 12 17:47:00 CET 2020


Dear Maxime,

On 12.03.20 17:43, Maxime Van den Bossche via DFTB-Plus-User wrote:
> Hi Bálint! Thanks for the clarification; along the same lines, I
> assume that too-few-lines then lead to zero-padded integrals in
> DFTB+. /Maxime

No, too few lines should trigger an error! Are you aware any cases,
where in your opinion there are too few lines?

Best regards,

Bálint


-- 
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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