Adsorption of Hexavalent Chromium on Raw and Activated Cassava Rhizome: Kinetic Analysis Using Mechanistic and Empirical (Regression and ANN) Models

IF 1.7 4区 化学 Q4 CHEMISTRY, PHYSICAL
Amira Ali Mohammed Makoof Zabanoot, Fatima Mahad Said Issa Al Amri, Hanan Nooh Bilal Al Hamir, Lubna Musallam Ahmed Al Hadhri, Miysam Yaslam Al Abd Al-Hadhrami, Selvaraju Sivamani
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Abstract

Heavy metals adsorption by adsorbents prepared from natural materials is a low-cost, effective method for their removal from aqueous environments. This study aims to investigate the kinetic studies on the adsorption of hexavalent chromium from its aqueous solution on raw and activated cassava rhizome. The coarse and fine raw cassava rhizome powder was activated by thermal (drying), pyrolysis, 1% (v/v) acetic acid, and 1% (w/v) KOH solutions. The batch adsorption studies were carried out by varying time (0–60 min) with adsorption capacity (meq/g) as a dependent variable. Adsorption capacity increased with an increase in time up to 40 min and then remained constant for all adsorbents with variation in adsorption capacity from 1.5 to 2.1 meq/g in the order of fine pyrolysis > fine thermal > fine acid = coarse pyrolysis > fine alkali = coarse thermal > coarse acid > coarse alkali > raw fine > raw coarse. Then, the effect of time on adsorption capacity data was fit to mechanistic models of pseudo-first, pseudo-second, zeroth, and half-order kinetics. Adsorption of hexavalent chromium on raw coarse and fine cassava rhizome powder followed pseudo-first-order kinetics. Also, the data were fit to empirical models based on regression and neural network, and the goodness of model fit was evaluated using the correlation coefficient (R). Regression analysis indicates the optimal fit with an R value of 0.9948 when the effect of time on adsorption capacity was investigated. Neural network analysis reveals the best fit at an R value of 0.9985. Hence, a higher rate constant for fine particles compared to coarse particles indicates that fine particles have a greater effective surface area and enhanced diffusional properties, facilitating more efficient adsorption, which suggests that the finer particles interact more with the adsorbate, allowing for quicker transport and adsorption processes.

生的和活化的木薯根茎对六价铬的吸附:基于机制和经验(回归和神经网络)模型的动力学分析
利用天然材料制备的吸附剂吸附重金属是一种低成本、有效的去除水中重金属的方法。研究了生木薯根和活化木薯根对六价铬水溶液的吸附动力学。采用热(干燥)、热解、1% (v/v)乙酸和1% (w/v) KOH溶液对粗、细木薯根茎粉进行活化。以吸附量(meq/g)为因变量,通过不同时间(0-60 min)进行间歇吸附研究。各吸附剂的吸附量随时间的增加而增大,达到40min后保持不变,吸附量从1.5 ~ 2.1 meq/g的变化顺序为:细热解>;细热>;细酸=粗热解>;细碱=粗热>;粗酸>;粗碱>;粗细>;粗粗。将时间对吸附量的影响拟合为准一级、准二级、零级和半级动力学模型。粗、细木薯根茎粗粉对六价铬的吸附符合准一级动力学。采用回归和神经网络方法对数据进行拟合,并用相关系数R评价模型的拟合优度。回归分析表明,当考察时间对吸附量的影响时,R值为0.9948。神经网络分析表明,R值为0.9985时拟合最佳。因此,与粗颗粒相比,细颗粒的速率常数更高,表明细颗粒具有更大的有效表面积和增强的扩散特性,有利于更有效的吸附,这表明细颗粒与吸附质的相互作用更多,从而允许更快的运输和吸附过程。
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来源期刊
CiteScore
3.30
自引率
6.70%
发文量
74
审稿时长
3 months
期刊介绍: As the leading archival journal devoted exclusively to chemical kinetics, the International Journal of Chemical Kinetics publishes original research in gas phase, condensed phase, and polymer reaction kinetics, as well as biochemical and surface kinetics. The Journal seeks to be the primary archive for careful experimental measurements of reaction kinetics, in both simple and complex systems. The Journal also presents new developments in applied theoretical kinetics and publishes large kinetic models, and the algorithms and estimates used in these models. These include methods for handling the large reaction networks important in biochemistry, catalysis, and free radical chemistry. In addition, the Journal explores such topics as the quantitative relationships between molecular structure and chemical reactivity, organic/inorganic chemistry and reaction mechanisms, and the reactive chemistry at interfaces.
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