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Modeling the adsorption of hydrogen sodium chloride and phthalate on goethite using a strict charge-neutral ion-exchange theory

机译:使用严格的电荷中性离子交换理论模拟针铁矿上氢钠氯和邻苯二甲酸酯的吸附

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摘要

Simultaneous adsorption modeling of four ions was predicted with a strict net charge-neutral ion-exchange theory and its corresponding equilibrium and mass balance equations. An important key to the success of this approach was the proper collection of all the data, particularly the proton adsorption data, and the inclusion of variable concentrations of conjugate ions from the experimental pH adjustments. Using IExFit software, the ion-exchange model used here predicted the competitive retention of several ions on goethite by assuming that the co-adsorption or desorption of all ions occurred in the correct stoichiometries needed to maintain electroneutrality. This approach also revealed that the retention strength of Cl ions on goethite increases in the presence of phthalate ions. That is, an anion-anion enhancement effect was observed. The retention of Cl ions was much weaker than phthalate ions, and this also resulted in a higher sensitivity of the Cl ions toward minor variations in the surface reactivity. The proposed model uses four goethite surface sites. The drop in retention of phthalate ions at low pH was fully described here as resulting from competitive Cl reactions, which were introduced in increasing concentrations into the matrix as the conjugate base to the acid added to lower the pH.
机译:使用严格的净电荷中性离子交换理论及其相应的平衡和质量平衡方程,对四种离子的同时吸附模型进行了预测。这种方法成功的一个重要关键是正确收集所有数据,尤其是质子吸附数据,以及从实验pH调节中包含可变浓度的共轭离子。通过使用IExFit软件,此处使用的离子交换模型通过假设所有离子的共吸附或解吸发生在维持电子中性所需的正确化学计量比中,从而预测了几种离子在针铁矿上的竞争性保留。该方法还表明,在邻苯二甲酸盐离子的存在下,Cl -离子在针铁矿上的保留强度增加。即,观察到阴离子-阴离子增强作用。 Cl -离子的保留能力比邻苯二甲酸离子弱得多,这也导致Cl -离子对表面反应性的微小变化具有更高的敏感性。所提出的模型使用四个针铁矿表面部位。此处充分描述了由于竞争性Cl -反应而导致的邻苯二甲酸盐离子在低pH值下的保留下降,该竞争反应以浓度递增的形式引入基质中,作为添加到酸中的共轭碱以降低pH 。

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