[CP2K-user] Becke-Johnson damping function - DFT-D3

Stanislav Ċ imko stanisl... at gmail.com
Tue Oct 16 10:15:29 CEST 2018


Thank  you very much!

On Friday, January 11, 2013 at 1:50:24 PM UTC+1, Sandeep Kumar Reddy wrote:
>
> Dear all,
>               Is it possible to use Becke-Johnson function (DFT-D3) in 
> cp2k ? (vanderWaals interaction)? If so, which keywords should i use?
>
> Thanks.
>
> Regards,
> Sandeep
>
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