腐植酸中不同分子量组分与As(Ⅲ)的络合性能

采用超滤方法将腐植酸（HA）分成5个不同分子量组分,利用平衡透析法研究HA中不同分子量组分与As（III）的络合特征和作用机理,计算络合过程的条件分配系数、表观稳定常数.结果表明,腐植酸组分的分子量对HA与As（III）的络合过程有显著的影响,当分子量小于10kDa时,HA与As（III）络合能力明显强于其他条件.其中羧基和酚羟基在HA与砷络合中起重要作用,为主要络合位点.采用Scatchard分析和双位点配体模型对络合结果进行拟合,发现HA中不同分子量组分和As（III）的络合过程中均存在强和弱2种络合位点.     

不同地域天然伊利石表面酸碱特性的比较

利用电位滴定技术和恒定容量表面络合模式表征不同来源天然伊利石的表面酸碱性质。鉴于固体基质在酸量滴定过程中发生溶解，相应的滴定上清液被视为体系空白。考虑到水解铝、硅酸和伊利石表面活性位之间的表面络合或沉淀反应，提出两种表面质子反应模型。对其中的特例，还考虑了表面离子交换反应。模拟程序的拟合结果显示两种模型对水解伊利石体系的滴定行为均可获得满意的描述。相的的表面固有酸度常数表明样品的酸碱性质之间存在一些共性。     

重金属离子在腐殖酸表面的吸附——类颗粒表面吸附模型

本实验用伏安质子滴定法获得重金属离子(Cu~(2+)、Pb~(2+)、Cd~(2+))在腐殖酸表面吸附的实验数据,并基于这些数据提出重金属离子在腐殖酸表面的络合模型。模型中引入两个实验常数:反应系数α和竞争反应常数K_H。实验结果表明,这两个常数的实验值在一相当宽的起始溶液条件下基本稳定。基于这两个常数而获得的pH相关吸附等温线和实验数据相当符合。模型中采用了由电位滴定得到的腐殖酸表面羧基浓度作为最大表面基团浓度,并对其质子解离常数进行了表面电荷影响的修正。     

铝酸钙去除水中氟离子的条件研究

采用铝酸钙粉,进行去除模拟废水中氟离子的条件研究,并进行了pH值、温度等多项条件的系列实验。实验得出,当氟离子浓度为215mg/L,反应溶液为200mL,反应温度是影响去除率的主要因素,去除主要发生在前15min,除氟主要依靠沉淀、络合等作用。pH为11,40℃时,投加量50g/L时,去除率可以达到95.7%以上,出水可直接达标。     

Heavy metal adsorption on the Le An River sediment —The adsorption model

In this study,the surface properties and adsorption properties of the Le An River sediment were modelled via surface complexation approach.The model parameters were determined based on the data of our potentiometric titration experiments and the metal adsorption experiments with the Le An River sediment samples.Consequently,the surface complexation models for the natural sediment,in our case the Le An River sediments,which can interpret the experimental data very well were successfully established.Three typical surface complexation models that is the constant capacitance model,the diffuse layer model and the triple layer model,were considered in this research.This work indicated that the consistency and the interdependency among model parameters together with the selection of the surface adsorbed species should be emphasized.     

Recent developments of surface complexation models applied to environmental aquatic chemistry

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砷在金属氧化物/水界面上的吸附机制Ⅱ.电荷分布多位络合模型模拟

利用电位滴定表征了铁铈氧化物(Fe-Ce)的表面电荷特性,并使用电荷分布多位络合模型(CD MUSIC)进行了模拟,得到Fe-Ce材料的表面位质子结合常数为5.8,位密度为23.2个·nm-2,高于大多数铁氧化物的表面位密度.在Fe-Ce表面特性参数的基础上,进一步使用CDMUSIC模型对系列pH(5～9)下As(Ⅴ)在Fe-Ce表面的等温吸附实验进行了模拟.结果表明,单齿单核单质子化形态≡FeOAsO3H1.5-和双齿双核非质子化形态≡Fe2O2AsO22-共存于吸附后的Fe-Ce表面,它们的结合常数分别为31.5和34.2,电荷分布值(f)分别为0.25和0.50.使用以上模型参数,对pH 3.5～10.5范围内2种表面络合形态分布趋势进行了预测.结果表明,在偏酸性条件下,≡ FeOAsO3H1.5-形态占主导;而≡Fe2O2AsO22-形态主要存在于偏碱性的范围.     

砷与无定形氧化铝的表面络合反应平衡常数计算

根据不同离子浓度、不同pH值的溶液中As在无定形氧化铝表面的吸附量,利用三种不同的表面络合模型计算As与无定形氧化铝表面络合反应的平衡常数,将计算得到的平衡常数模拟 As(Ⅲ)无定形在氧化铝表面各个络合物种的吸附百分比与 As(Ⅲ)的 X光吸收光谱边缘结构分析结果进行定性比较,表明计算结果与分析结果较为吻合.从而验证了此次计算得到的平衡常数是准确的.     

Part V—sorption of pharmaceuticals and personal care products

Background, aim, and scope  Pharmaceuticals and personal care products (PPCPs) including antibiotics, endocrine-disrupting chemicals, and veterinary pharmaceuticals are emerging pollutants, and their environmental risk was not emphasized until a decade ago. These compounds have been reported to cause adverse impacts on wildlife and human. However, compared to the studies on hydrophobic organic contaminants (HOCs) whose sorption characteristics is reviewed in Part IV of this review series, information on PPCPs is very limited. Thus, a summary of recent research progress on PPCP sorption in soils or sediments is necessary to clarify research requirements and directions. Main features  We reviewed the research progress on PPCP sorption in soils or sediments highlighting PPCP sorption different from that of HOCs. Special function of humic substances (HSs) on PPCP behavior is summarized according to several features of PPCP–soil or sediment interaction. In addition, we discussed the behavior of xenobiotic chemicals in a three-phase system (dissolved organic matter (DOM)–mineral–water). The complexity of three-phase systems was also discussed. Results  Nonideal sorption of PPCPs in soils or sediments is generally reported, and PPCP sorption behavior is relatively a more complicated process compared to HOC sorption, such as the contribution of inorganic fractions, fast degradation and metabolite sorption, and species-specific sorption mechanism. Thus, mechanistic studies are urgently needed for a better understanding of their environmental risk and for pollution control. Discussion  Recent research progress on nonideal sorption has not been incorporated into fate modeling of xenobiotic chemicals. A major reason is the complexity of the three-phase system. First of all, lack of knowledge in describing DOM fractionation after adsorption by mineral particles is one of the major restrictions for an accurate prediction of xenobiotic chemical behavior in the presence of DOM. Secondly, no explicit mathematical relationship between HS chemical–physical properties, and their sorption characteristics has been proposed. Last but not least, nonlinear interactions could exponentially increase the complexity and uncertainties of environmental fate models for xenobiotics. Discussion on proper simplification of fate modeling in the framework of nonlinear interactions is still unavailable. Conclusions  Although the methodologies and concepts for studying HOC environmental fate could be adopted for PPCP study, their differences should be highly understood. Prediction of PPCP environmental behavior needs to combine contributions from various fractions of soils or sediments and the sorption of their metabolites and different species. Recommendations and perspectives  More detailed studies on PPCP sorption in separated soil or sediment fractions are needed in order to propose a model predicting PPCP sorption in soils or sediments based on soil or sediment properties. The information on sorption of PPCP metabolites and species and the competition between them is still not enough to be incorporated into any predictive models.     

土壤水溶解态有机物质与重金属的络合作用

水溶解态有机物质与重金属离子的络合反应对土壤重金属化学行为的影响十分显著。文章综述了土壤水溶解态有机物质与重金属离子之间相互作用的研究进展,讨论了水溶解态有机物质与络合反应有关的性质,以及水溶态有机物质与重金属的络合作用的问题。