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. 2014 Jun 2;111(24):8729–8734. doi: 10.1073/pnas.1403294111

Fig. 1.

Fig. 1.

(A) The schematic shows an oppositely charged M+M ion pair separated by r and situated in a plane at a distance z from the interface. The z axis is normal to the plane of the average vapor–liquid interface (z=0), with z>0 being the liquid side. (B) PMF between M+ and M ions calculated in various z planes. We set W(r|z)=0 in each z plane at r = 1.2 nm for reference. (C) The 3D W(r,z) PMF landscape for the M+M ion pair in which an ion pair separated by 1.2 nm and located at z=1 is used as a reference state; i.e., W(r=1.2,z=1)=0. This landscape highlights the work needed to move an ion pair from bulk water to the interfacial region.