[DFTB-Plus-User] Waveplot coefficients for 3ob

Bálint Aradi balint.aradi at bccms.uni-bremen.de
Thu Jul 31 15:06:07 CEST 2014


Dear Zack,

On 07/30/2014 08:07 PM, Zachary Ulissi wrote:
> Does anyone have suggestions for this?  Is there a way to generate the
> coefficients from the sets online?

I created an appropriate wfc file, you can download it from the website.
I did not have the time to test it as I am leaving for vacation very
soon. Let me know, if there are problems with it.

  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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