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Surface Tension of Simple Molten Salts: Insight from a Charged Hard Sphere Model.

Tiejun XiaoYun ZhouHui-Jun Jiang
Published in: The journal of physical chemistry. B (2024)
Surface tension of molten salts is rooted in many important phenomena in physical chemistry. We develop an analytical theory for the surface tension of molten salts, where the molten salt is described by a restricted primitive model electrolyte consisting of charged hard spheres, and surface tension is related to the formation of a cavity in the electrolyte. The integral equation theory is applied to the restricted primitive model electrolyte to derive an analytical formula of the cavity formation energy. The scaling relation of the cavity formation energy is further combined with morphological thermodynamics theory to determine the formula for surface tension. According to our formula, surface tension consists of a positive hard sphere contribution and a negative electrostatic contribution. Using the molar mass, interionic distance, density, and temperature as the input, our theory leads to a good prediction of surface tension of more than 16 molten salts at their melting point without introducing any adjustable parameters.
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