[DFTB-Announce] New SK-sets on DFTB.ORG

[Bálint Aradi]

Dear Slako-Users,

  three new Slater-Koster sets had been uploaded to DFTB.ORG. One of
them is the long awaited extension of the mio-set with phosphorous, and
two additional special sets modifying the N-H and H-H interactions of
the mio-set for certain special cases. All three sets were provided by
the group of M. Elstner (KIT). See the individual pages for the new sets
(mio-1-1, miomod:hh-0-1, miomod:nh-0-1) for further details.

  We hope that you'll find the new sets useful.

  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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