In almost all profiles, polarization MEs demonstrate an underestimate of the polarization energy (with MEs being positive since E pol is a negative quantity) while charge transfer interactions are all consistently underestimated. The only exception (see supporting material) are the x-direction hydrogen profiles which had a ME of -0.29 kJ/mol. On an individual level, Figure also demonstrates this phenomena at the equilibrium interaction distances for some stacked profiles. This figure is also used as opposed to showing the entire profile, like in Figure , as the underestimate/overestimate of energies created overlapping and confusing plots. This trend can also be seen in some H-bonds in Figure near the minimum of the ŷ and ẑ energy profiles.