[molpro-user] DFT-D3 parameters

Leonid Shirkov leonid.shirkov at gmail.com
Mon Aug 7 17:49:27 CEST 2017


Dear Molpro superusers,

is it possible to adjust the parameters of DFT-D (s6,s8, alpha6, alpha8, etc)
in the input without recompiling?
The commands "scale" and "alpha" do not work, at least not with D3.

Regards,
Leonid


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