Different DFTB in CP2K and DFTB+

Geng Sun sungen... at gmail.com
Wed Jul 15 09:07:06 UTC 2015

Dear CP2K users

      What's the difference of DFTB method in CP2K and that in DFTBplus 

      Are  the spl files in cp2k/data/DFTB  same as what's supplied skf 
files in DFTBplus website ? are they compatible ?

      Geng Sun

Thanks !

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