海堤渗压神经网络分布模型的建立及规律分析

为有效揭示海堤渗压的分布特征,掌握其在临海工作环境下的特殊规律,在利用神经网络建模优点的同时,采用多测点渗压监控信息,并将测点坐标因素加入到输入层,综合前期潮位因子、积分型降雨因子、时效因子,形成海堤渗压神经网络安全监控分布模型结构,以实测信息进行建模训练计算;在获得合理训练结果基础上,根据输入层因子补充插入坐标样本,获得不同位置的渗压模型值及渗压分布曲线.文中以广义回归神经网络为例,结合浦东海堤实测资料,以实例说明以上述方法在神经网络不提供显式的情况下,建立可获得分布曲线的监控模型,并以此对海堤渗压分布规律特色加以分析.     

Influence of Substitutional Defects in ZIF-8 Membranes on Reverse Osmosis Desalination: A Molecular Dynamics Study

In this study, molecular dynamics simulation is used to investigate the effects of water-based substitutional defects in zeolitic imidazolate frameworks (ZIF)-8 membranes on their reverse osmosis (RO) desalination performance. ZIF-8 unit cells containing up to three defect sites are used to construct the membranes. These substitutional defects can either be Zn defects or linker defects. The RO desalination performance of the membranes is assessed in terms of the water flux and ion rejection rate. The effects of defects on the interactions between the ZIF-8 membranes and NaCl are investigated and explained with respect to the radial distribution function (RDF) and ion density distribution. The results show that ion adsorption on the membranes occurs at either the nitrogen atoms or the defect sites. Complete NaCl rejection can be achieved by introducing defects to change the size of the pores. It has also been discovered that the presence of linker defects increases membrane hydrophilicity. Overall, molecular dynamics simulations have been used in this study to show that water-based substitutional defects in a ZIF-8 structure reduce the water flux and influence its hydrophilicity and ion adsorption performance, which is useful in predicting the type and number of defect sites per unit cell required for RO applications. Of the seven ZIF-8 structures tested, pristine ZIF-8 exhibits the best RO desalination performance.     

自支撑NH2-MIL-125/聚噁二唑复合正渗透膜的制备及性能

合成了高强度亲水性含羧基聚噁二唑材料(POD-COOH)和含氨基金属有机框架材料(NH₂-MIL-125), 以NH₂-MIL-125为填料, 与POD-COOH基体材料进行溶液共混, 并通过溶液浇铸法制备系列新型自支撑复合正渗透膜, 研究NH₂-MIL-125的引入对复合正渗透膜结构和性能的影响. 研究结果表明, 所制备的系列复合正渗透膜均呈致密结构, 且随着NH₂-MIL-125含量的增加, 复合膜的表面亲水性增加、 电负性增强, 并保持良好的机械性能. 以去离子水为进料液, 1.5 mol/L硫酸钠溶液为汲取液, 对上述自支撑复合膜进行正渗透性能测试, 发现由于消除了传统正渗透膜支撑层的内浓差极化现象, 该新型复合正渗透膜在分离过程中具有优异的正渗透性能.     

Thermoresponsive Ionic Liquid/Water Mixtures: From Nanostructuring to Phase Separation

The thermodynamics, structures, and applications of thermoresponsive systems, consisting primarily of water solutions of organic salts, are reviewed. The focus is on organic salts of low melting temperatures, belonging to the ionic liquid (IL) family. The thermo-responsiveness is represented by a temperature driven transition between a homogeneous liquid state and a biphasic state, comprising an IL-rich phase and a solvent-rich phase, divided by a relatively sharp interface. Demixing occurs either with decreasing temperatures, developing from an upper critical solution temperature (UCST), or, less often, with increasing temperatures, arising from a lower critical solution temperature (LCST). In the former case, the enthalpy and entropy of mixing are both positive, and enthalpy prevails at low T. In the latter case, the enthalpy and entropy of mixing are both negative, and entropy drives the demixing with increasing T. Experiments and computer simulations highlight the contiguity of these phase separations with the nanoscale inhomogeneity (nanostructuring), displayed by several ILs and IL solutions. Current applications in extraction, separation, and catalysis are briefly reviewed. Moreover, future applications in forward osmosis desalination, low-enthalpy thermal storage, and water harvesting from the atmosphere are discussed in more detail.     

Associative thickeners. Part I: Synthesis,rheology and aggregation behavior

Nonionic associative thickeners with systematic changes in chemical composition have been synthesized. Rheological measurements of thickened latexes are presented as well as measurements of relaxation times, intrinsic viscosity and osmotic pressure of polymers in pure water solution. We find that the general hydrophobicity of the polymers' end groups control both rheology and efficiency. Hydrophobic parts in the interior of the polymer do not seem to effect rheology in latex systems. Viscosity increases with molecular weight in the low molecular region (Mw<10000), and passes through a maximum in the high molecular region. The thickeners seem to form micelle-like aggregates even at very low concentrations, while at higher concentrations the viscoelastic properties may be modeled by means of one Maxwell element. Only the network relaxation times but not the network structure seems to be dependent on the polymers' end group.     

Predicting ion selectivity in water purification by capacitive deionization: Electric double layer models

Ion-selective water treatment is needed to address emerging problems in an energy- and cost-efficient manner. Capacitive deionization (CDI) is a membraneless water treatment technology, which relies on storing ions in charged electric double layers (EDLs) of micropores. CDI has shown remarkable selectivity, with local density approximations (LDAs) showing some success in guiding selective separations. However, many underlying processes are represented by lumped fitting parameters in LDA models, hindering further progress. Atomistic models help unravel selectivity mechanisms, but are difficult to integrate with cell-level CDI theory. Here, we review and extend LDA models for CDI, highlight a knowledge gap in connecting between LDA and atomistic models for CDI, and emphasize and build upon analogies between micropore EDLs and nanofiltration membranes.     

聚电解质型正渗透汲取液

聚电解质作为正渗透汲取液具有渗透压高、溶质反向渗透、易于回收等特点,符合理想正渗透汲取液的要求。此外,多种分离方法诸如纳滤、超滤和热处理可用于其回收,使得聚电解质型汲取液成为诸如氯化钠等的传统无机汲取液的理想代替物。近年来关于聚电解质型汲取液的研究日益增加,而聚电解质型汲取液较无机型汲取液有许多独特的性质,应对相关研究进展予以总结。本文以聚电解质的化学结构分类对其研究进展进行了概述。重点总结了不同种类聚电解质的分子量、渗透压、黏度等性质,以及正渗透过程的水通量及溶质反向渗透情况,同时还介绍了相应的正渗透机理。最后,探讨和总结了各类汲取液的特点,并展望了未来的研究方向。     

一种新型聚酰亚胺-氨酯反渗透复合膜材料的合成及表征

采用关键功能单体N,N'-二甲基间苯二胺(DMMPD)和多元酰氯5-氯甲酰氧基-异肽酰氯(CFIC)聚合制备了一种耐氧化的聚酰亚胺-氨酯(DMMPD-CFIC)反渗透复合膜材料. 研究了水相溶剂、 多元胺浓度和组成及两相接触时间等因素对DMMPD聚合成膜的影响. 结果表明, 虽然DMMPD-CFIC膜的脱盐率不够理想, 但将4-甲基间苯二胺(MMPD)与DMMPD以2∶1(质量比)组合后制得的MMPD/DMMPD-CFIC膜的脱盐率得到显著提高, 并且对膜的耐氯性能影响不大. 采用傅里叶衰减全反射红外光谱(FTIR)和X射线光电子能谱(XPS)分析了2种膜的活性层的结构, 并利用扫描电镜(SEM)和原子力显微镜(AFM)对膜的表面形态进行了表征.     

磁性水凝胶的制备及其在正渗透中的应用

在Fe3O4纳米磁流体存在的情况下,将强离子型单体2-丙烯酰胺基-2-甲基丙磺酸钠(AMPS)与温敏单体N-异丙基丙烯酰胺(NIPAM)共聚,制备了磁性水凝胶[P(NIPAM-co-AMPS)/MNPs],并将其用作正渗透汲取剂.表征结果证实:磁性水凝胶显示超顺磁性,其饱和磁化强度与Fe3O4磁性纳米粒子(MNPs)含量呈线性关系.正渗透实验结果表明:引入MNPs对磁性水凝胶水通量影响很小,不同MNPs含量的磁性水凝胶在0.5h内平均水通量范围为2.22~2.52L·m-2·h-1;在不同膜方向模式下,磁性水凝胶表现出可忽略的水通量差异,可避免稀释内部浓差极化问题,同时具有重复使用的优点;在温度刺激下(65℃),引入MNPs可提高磁性水凝胶的脱水效率,质量分数为9.0%的MNPs的磁性水凝胶在最初20min内的脱水率是不含MNPs水凝胶的3.2倍.