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. 2017 Oct 11;9(1):62–69. doi: 10.1039/c7sc02208e

Fig. 5. Flat configuration. Relative changes in the charge density in comparison to the zero bias, ΔρV,0 = ρVρ0 for (a) V = +1.5 V and (b) V = –1.5 V (isosurface values = ±8.1 × 10–4 e per Å3). Insets show an xy-sectional plane taken at the water molecule center of mass. (c) Charge density fluctuation at positive and negative applied biases, i.e. ΣΔρ = Δρ1.5,0 + Δρ–1.5,0 (isosurface value = ±5.4 × 10–5 e per Å3). In all of the cases, red (blue) indicates an excess (deficiency) of electrons. (d) Laterally averaged difference in the charge density in comparison to the zero bias: black for +1.5 V and red for –1.5 V; the water–metal system indicates the position of the atoms.

Fig. 5