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基于传质模型推导的常用批量吸附动力学模型分析。

Analysis of commonly used batch adsorption kinetic models derived from mass transfer-based modelling.

机构信息

Departamento de Engenharia Química, Escola de Engenharia, Universidade Federal Do Rio Grande Do Sul, Rua Ramiro Barcelos, 2777 - Prédio 22202, Porto Alegre, RS, 90035-007, Brazil.

Departamento de Físico-Química, Instituto de Química, Universidade Federal Do Rio Grande Do Sul, Av. Bento Gonçalves, Porto Alegre, RS, 950091501-970, Brazil.

出版信息

Environ Sci Pollut Res Int. 2022 Nov;29(53):79875-79889. doi: 10.1007/s11356-021-18479-y. Epub 2022 Jan 11.

Abstract

Modelling of liquid-solid batch adsorption based on mass transfer and conservation equations results in differential equations that may have or not an analytical solution. Even when analytical solutions are available, several simplified models can be considered for evaluating kinetic data of batch adsorption experiments. However, these simplified models are commonly used regardless of the premises considered in its development, and the analysis of the kinetic experiments based on these simplified models may be severely compromised. For this reason, this work presents a detailed development of the phenomenological models, and the hypotheses considered in its development are clearly stated. Typical simplified models derived from the phenomenological ones are obtained, and the conditions considered in the simplification are critically assessed. It was observed that the simplified models fail mainly for considering the concentration of the bulk phase constant over time or considering a linear adsorption isotherm. It must be emphasised that even when phenomenological models must be solved through numerical procedures, its use must be preferred, since the agreement with model premises and experimental conditions are closer, ensuring the quality of the kinetic data analysis.

摘要

基于传质和守恒方程的固-液间歇吸附模型会产生微分方程,这些微分方程可能有也可能没有解析解。即使有解析解,也可以考虑几种简化模型来评估间歇吸附实验的动力学数据。然而,这些简化模型通常被不加区分地使用,而不管其开发过程中考虑的前提条件如何,并且基于这些简化模型的动力学实验分析可能会受到严重影响。出于这个原因,这项工作详细介绍了唯象模型的开发过程,并明确说明了其开发过程中考虑的假设条件。得到了从唯象模型推导出来的典型简化模型,并对简化过程中考虑的条件进行了批判性评估。观察到,简化模型主要在考虑主体相浓度随时间不变或考虑线性吸附等温线时失效。必须强调的是,即使唯象模型必须通过数值程序来求解,也必须优先使用它,因为它与模型前提和实验条件的一致性更接近,从而保证了动力学数据分析的质量。

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