Modeling self‐diffusion coefficients of ionic liquids using ePC‐SAFT and FVT combined with Einstein relation
Zhida Zuo,
Xiaohua Lu,
Xiaoyan Ji
Abstract:The electrolyte perturbed‐chain statistical associating fluids theory (ePC‐SAFT) coupled with free volume theory (FVT) was combined with Einstein relation, that is, ePC‐SAFT‐FVT‐E, to describe self‐diffusion coefficients (SDCs) of ionic liquids (ILs). In modeling, ePC‐SAFT was used to calculate density, while FVT parameters, determined from viscosity data, were utilized to calculate the summation of ionic SDCs through the Einstein relation with one parameter. Two strategies were employed to determine this para… Show more
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