[CP2K:7829] van der Waals interactions

S Ling lingsa... at gmail.com
Tue Jun 7 01:03:55 CEST 2016


Hi

The Tkatchenko-Scheffler vdW correction is not available in CP2K, but a
range of other vdW correctted DFT methods have been implemented in CP2K,
see:

https://www.cp2k.org/_media/events:2015_cecam_tutorial:ling_vdw.pdf

SL


On 6 June 2016 at 07:41, SaeeD PourasaD <saeedp... at gmail.com> wrote:

> Dear CP2K users ,
>
> Is It possible to use van der Waals interactions in CP2K ?
> For example : with using of this paper :
> http://journals.aps.org/prb/pdf/10.1103/PhysRevB.87.064110 , it is
> possible for VASP !
>
> Thanks for your attention.
> Regards,
> Saeed.
>
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