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Shock Electrodialysis for Water Purification and Electrostatic Correlations

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Shock Electrodialysis for Water Purification and Electrostatic Correlations ( shock-electrodialysis-water-purification-and-electrostatic-c )

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Electrolyte Type / Concentration 1:1 / 1 mM 1:1 / 10 mM 1:1 / 100 mM 1:2 / 10 mM 2:1 / 10 mM Surface Charge (mC/m2) -10.42 -20.80 -38.39 -25.59 -36.90 Zeta Potential (mV) -90.23 -68.69 -46.52 -61.61 -48.08 Table 3.2: Surface Charge and Zeta Potential for the Shock Electrodialysis Prototype Outlet Conditions (Boundary 4) Boundary 4 is the outlet to the system. Here we only specify the outlet pressure (P ̃ = P1), which together with the inlet pressure condition determines the normal pressure drop across the system. Furthermore, since we are far removed from the region of applied current/potential, we can safely assume that there is no longer a normal electric field (∂φ ̃ = 0). Lastly, we assume an outflow boundary condition ∂ x ̃ for the anions, meaning we assume that the concentration no longer changes in the normal direction (∂c ̃− = 0). ∂ x ̃ 3.2.3 Surface Charge Model The surface charge of the silica frit was calculated using the following equations [9, 102]: kBT􏱒 􏱐 −σ 􏱑 􏱓 σ ζ(σ) = e ln eΓ+σ +ln(10)(pK −pH) − C (3.22) 􏱠 􏱒 􏱐 z+eψ􏱑 􏱐 z−eψ􏱑 σ(ζ)=sign(ζ) 2kBTc0εw s+exp −kBT +s−exp −kBT −s+−s− 􏱓 (3.23) Equation 3.23 is based on the Gouy-Chapman model and reduces to the Grahame equation for binary symmetric electrolytes. The values for surface charge and zeta potential used in the simulations are shown in table 3.2. 83

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