Hello,
I am running 1D-rism for water and octanol. In the rism1d thermo output,
there is a "Solvation_energy". As the 1D rism is only for solvents, I am
wondering how this solvation_energy is calculated, and the physical meaning
of this term.
Many Thanks,
Joy
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Received on Tue May 24 2016 - 16:00:02 PDT
