[gpaw-users] DFT-Dx
Michael Walter
Michael.Walter at fmf.uni-freiburg.de
Tue Mar 19 12:22:51 CET 2013
2013/3/19 Torsten Hahn <Torsten.Hahn at physik.tu-freiberg.de>
> Hi all,
>
> is there an implementation of the dispersion correction(s) DFT-D2 or
> DFT-D3 introduced by Grimme et. al available in gpaw?
>
there is TS09:
https://wiki.fysik.dtu.dk/gpaw/documentation/xc/vdwcorrection.html
>
> Best,
> Torsten.
>
>
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PD Dr Michael Walter
Address: Freiburger Materialforschungszentrum
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