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Prediction of Multicomponent Diffusion Coefficients in Liquids

机译:液体中多组分扩散系数的预测

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Knowledge of diffusion coefficients in liquids is of great interest for the calculation and simulation of mass transfer processes. In the literature, several prediction models for binary diffusion coefficients are found. For multicomponent systems, however, only a few models exist. Due to lack of ternary diffusion data, these models have not been verified for real systems until now. To overcome this limitation, multicomponent diffusivities were measured within the whole concentration space of several ternary systems. Fick diffusivities were transformed to less concentration-dependent Maxwell-Stefan diffusivities using the thermodynamic correction factor. Four prediction. models were tested by a comparison of predicted values to experimental data. In some systems, multicomponent diffusion prediction shows promising results. However, the quality of predicted diffusion coefficients strongly depends on an accurate thermodynamic description of the system.
机译:液体中扩散系数的知识对于传质过程的计算和仿真非常关注。在文献中,找到了用于二进制扩散系数的若干预测模型。然而,对于多组分系统,仅存在少数模型。由于三元扩散数据缺乏,这些模型尚未验证真实系统。为了克服这种限制,在几个三元系统的整个浓度空间内测量多组分扩散性。使用热力学校正因子将FIC扩散性转化为较少的浓度依赖的MAXWEL-Stefan扩散性。四个预测。通过对实验数据的预测值进行测试测试模型。在一些系统中,多组分扩散预测显示了有希望的结果。然而,预测的扩散系数的质量强烈地取决于系统的精确热力学描述。

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