[Wien] Van der Waal force inclusion

Peter Blaha pblaha at theochem.tuwien.ac.at
Thu May 22 13:13:56 CEST 2014


DFTD3 (and previous version) will be included in the next release of 
WIEN2k (in about 3-4 weeks).


On 05/22/2014 12:10 PM, Dileep Krishnan wrote:
> Hello users and developers,
>
> Is there any way to perform the DFTD2 method in any version of WIEN2k? I wanted to include Van der Waal's interactions to my bulk MoS2 calculations.
>

-- 

                                       P.Blaha
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