DFTB3 SK_FILE fromat
Sal
sria... at uci.edu
Tue Mar 6 19:20:36 UTC 2018
Dear CP2K Developers/Users,
I was wondering if the DFTB3-3OB parameter files provided at
https://www.dftb.org/parameters/download/3ob/3ob-3-1-cc/ can be directly
used in CP2K without any modification.
Thanks for your time,
Saleh
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