[DFTB-Plus-User] Wave function coeffs for 3ob-3-1

Bálint Aradi aradi at uni-bremen.de
Wed Aug 26 17:06:12 CEST 2015


Dear all,

As many people asked for it, I've uploaded the wfc file for 3ob-3-1 to
the dftb-plus.info website. I did not have time to check or reproduce
it, I just have put it there in the form as I've obtained from the
authors of the parametrization.

  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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