二元非线性吸附球形吸附剂中扩散的线性驱动力近似

Adélio M.M. Mendes, Carlos A.V. Costa, Alírio E. Rodrigues
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引用次数: 11

摘要

本文提出了一种新的线性驱动力近似,适用于在组成、总压或两者都具有周期性边界条件下,存在二元朗穆里安吸附的孔隙扩散情况下的循环稳态。这个近似使用两个参数Ω,一个为每个溶质,计算具有相同周期的方波,另一对参数用于校正相位滞后的近似。通过平均相对二次误差测量由扩散模型计算的累积通量与线性驱动力模型计算的累积通量之间的差异,对近似的质量进行了评估。结果表明,在实际吸附系统的平衡、扩散和频率条件下,该误差小于5%。同样的近似也可用于均匀扩散的情况。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
Linear driving force approximation for diffusion in spherical adsorbents with binary non-linear adsorption

This paper presents a new linear driving force approximation applicable to the cyclic steady-state in the case of pore diffusion in the presence of binary Langmuirian adsorption for a spherical particle under a periodic boundary condition in composition, total pressure or both. This approximation uses two parameters Ω, one for each solute, calculated for a square wave with the same period and a second pair of parameters that correct the approximation for the phase lags.

An assessment of the quality of the approximation was made by measuring the differences between the cumulative fluxes calculated by the diffusion and the linear driving force models through an average relative quadratic error. It is shown that this error is less than 5% for equilibrium, diffusion and frequency conditions in the range of practical adsorption systems. The same approximation can be used in the case of homogeneous diffusion.

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