[DFTB-Plus-User] calculation with 3ob-freq-1-1

Bálint Aradi balint.aradi at bccms.uni-bremen.de
Thu Jul 31 17:49:49 CEST 2014


Dear Richie,

> these files where added to the adf code. you can have a look:
> http://goo.gl/EpDnG7 - i put them into one zip file. also the included
> readme file gives no explanation gives no hint how to use these sk files.

Then, you should contact the ADF support in this case. Alternatively,
you can use the ones from the DFTB+ website.

  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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