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Nanofluidics for Gas Separation Applications: The Molecular Dynamics Simulation Perspective 纳米流体在气体分离中的应用:分子动力学模拟的视角
Pub Date : 2021-05-29 DOI: 10.1080/15422119.2021.1918720
Majid Shahbabaei, Daejoong Kim
ABSTRACT Since past decades, membrane science and technology have received great attention in academia and practice because of their potential for industrial applications. A diverse range of industrial applications has been benefited from this technology thanks to the advances in membrane science. Membranes are of paramount importance in chemical technology and play a key role in a broad range of applications.Membranes incorporating nanosize pores or channels have a tremendous contribution to membrane science discipline, particularly in gas separation technologies. Performing pore-level modeling with the help of computer simulation opens a route to membrane characterization in high accuracy and less observational. By utilizing molecular dynamics simulations, one can provide a fundamental understanding of the static and dynamic features of membranes at a molecular scale. In this work, we have reviewed the recent advances in nanofluidics for gas separation applications, with a major focus on the theoretical literature discussing the gas molecular transport mechanisms through the carbon-based nanopores. Describing the nanofluidics systems, solid-state nanopores, fabrication of nanofluidic devices, pore generation on graphene nanosheets, and pore-level flow modeling, this article expects to provide a platform for understanding the permeation and separation of gases across a variety of nanopores and attracting more attention of audiences from industry and academia.
摘要近几十年来,膜科学技术因其在工业上的应用潜力受到了学术界和实践界的高度关注。由于膜科学的进步,各种工业应用都受益于这项技术。膜在化学技术中具有至关重要的作用,在广泛的应用中发挥着关键作用。含纳米孔或纳米通道的膜对膜科学的发展有着巨大的贡献,特别是在气体分离技术方面。在计算机模拟的帮助下进行孔隙级建模,为高精度和较少观测的膜表征开辟了一条道路。通过分子动力学模拟,人们可以在分子尺度上对膜的静态和动态特征有一个基本的了解。本文综述了近年来纳米流体在气体分离领域的研究进展,重点介绍了碳基纳米孔中气体分子传输机制的理论研究。本文描述了纳米流体系统、固态纳米孔、纳米流体器件的制造、石墨烯纳米片上的孔生成以及孔级流动模型,希望为理解各种纳米孔中气体的渗透和分离提供一个平台,并吸引工业界和学术界的更多关注。
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引用次数: 3
Supported ionic liquid and polymer inclusion membranes for metal separation 用于金属分离的负载型离子液体和聚合物包合膜
Pub Date : 2021-05-29 DOI: 10.1080/15422119.2020.1846564
G. Zante, M. Boltoeva, Abderrazak Masmoudi, R. Barillon, D. Trébouet
ABSTRACT Background: Supported liquid membranes (SLMs) and polymer inclusion membranes (PIMs) are an interesting technology for the recovery and separation of metal ions. This kind of membranes could provide the advantages of hydrometallurgy (i.e. high selectivity, possibility to treat low concentration of metals …) without needing a large organic solvent inventory. Problem: However, the large-scale application of SLMs is limited because of the short lifetime of the process. Several authors claimed a longer lifetime when molecular diluents were replaced by ionic liquids (ILs). Possible solutions: In this review, recent advances on the extraction of metals from aqueous solutions using SLMs and PIMs based on ILs are summarized and discussed. The mechanisms of degradation are reported and the improvements as well as limitations outlined. In SLMs, ILs were shown to improve membrane stability. However, stability is improved with viscous ILs having low solubility in water. ILs were used in PIMs as plasticizers and/or carriers and have shown their potential. However, the effect of ILs on PIM structure is not fully understood. To date, extraction of anionic metallic species is the most relevant field of study for SLMs and PIMs. A larger variety of ILs could be studied to apply this technique for a broader range of metals.
背景:支撑液膜(SLMs)和聚合物包合膜(pim)是一种很有前途的金属离子回收分离技术。这种膜可以提供湿法冶金的优点(即高选择性,可以处理低浓度的金属…),而不需要大量的有机溶剂库存。问题:然而,由于过程的生命周期较短,slm的大规模应用受到限制。一些作者声称,当分子稀释剂被离子液体(ILs)取代时,寿命更长。可能的解决方案:本文综述和讨论了近年来利用基于液相色谱的slm和pim从水溶液中提取金属的研究进展。报告了退化的机制,并概述了改进和限制。在slm中,il被证明可以改善膜的稳定性。然而,粘度较低的il在水中的溶解度提高了稳定性。il作为增塑剂和/或载体应用于pim中,并已显示出其潜力。然而,il对PIM结构的影响尚不完全清楚。迄今为止,阴离子金属物种的提取是slm和pim最相关的研究领域。可以研究更多种类的il,以便将该技术应用于更广泛的金属。
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引用次数: 24
Recent Advances and Challenges of Deep Eutectic Solvent based Supported Liquid Membranes 深共晶溶剂基支撑液膜的研究进展与挑战
Pub Date : 2021-04-22 DOI: 10.1080/15422119.2021.1901742
Muhammad Mubashir, Fernanda Neira d’Angelo, F. Gallucci
ABSTRACT In the past few years, research on the fabrication of deep eutectic solvents (DESs)-based supported liquid membranes (SLMs) is increasing tremendously due to their significant advantages such as low mass transport resistance, high performance, easy scale-up, low cost and simple operation. However, fabrication of DES-based SLMs is challenging and highly dependent on the fabrication parameters: DES properties and properties of membrane supports. Subsequently, the fabrication methods, immersion, pressure-based impregnation and vacuum filtration also affect the permeation performance of DES-based SLMs in liquids and gases separation. Furthermore, the SLM durability is influenced by the DES properties and process parameters including: temperature, pressure, and feed composition. Firstly, present work reviews the current progress and fabrication of DES-based SLMs. Subsequently, it presents a perspective on different strategies that use DESs as a unique tunable platform to design advanced SLMs for liquids and gases separation reported in the literature. In the next step, performances of the SLMs membranes for liquids and gases separation are described in details. The effects of process parameters on DES-based SLMs are also highlighted prior to the challenges. Lastly, challenges and future research opportunities are highlighted.
摘要近年来,基于深共晶溶剂(DESs)的支撑液膜(SLMs)因其具有低质量传输阻力、高性能、易于放大、低成本和操作简单等显著优点,其制备研究得到了极大的发展。然而,基于DES的slm的制造是具有挑战性的,并且高度依赖于制造参数:DES性能和膜支撑的性能。随后,制备方法、浸渍、压力浸渍和真空过滤也影响了des基slm在液气分离中的渗透性能。此外,SLM耐久性受DES性能和工艺参数的影响,包括:温度、压力和进料成分。首先,本文综述了基于des的slm的研究进展和制备方法。随后,它提出了不同策略的观点,使用DESs作为一个独特的可调平台,设计先进的slm用于液体和气体分离的文献报道。在接下来的步骤中,详细描述了slm膜在液体和气体分离方面的性能。在面临挑战之前,还强调了工艺参数对基于des的slm的影响。最后,指出了未来的研究机遇和面临的挑战。
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引用次数: 3
Radioactive waste processing using membranes: State of the art technology, challenges and perspectives 利用膜处理放射性废物:最新技术、挑战和前景
Pub Date : 2021-03-23 DOI: 10.1080/15422119.2021.1878221
A. K. Pabby, B. Swain, N. Sonar, V. K. Mittal, T. Valsala, S. Ramsubramanian, D. Sathe, R. Bhatt, Sameer Pradhan
ABSTRACT Among the various separation technologies used to treat radioactive wastes, membrane technologies have been chosen in this article since they have many advantages over conventional processes. Membrane technology can be classified into different processes and, for each process, progress made till date in the radioactive decontamination of water is presented. The new directions are shown by considering advances made in membrane manufacturing and membrane processes. Thus, the combined efforts of the researchers who are engaged in membrane and membrane process design and in nuclear waste treatment were highlighted. This article focuses on applications of membrane technology in the nuclear industry and covers recent advances particularly in the field of radioactive liquid waste processing on laboratory, pilot and plant scale. Forward osmosis is highlighted for radioactive waste treatment as several recent publications pointed its potential. Some of our results Bhabha Atomic Research Centre, India) with respect to membrane-based processes are also presented.
在各种用于处理放射性废物的分离技术中,本文选择了膜技术,因为膜技术比传统方法具有许多优点。膜技术可分为不同的工艺,并针对每个工艺介绍了迄今为止在水的放射性去污方面取得的进展。结合膜制造和膜工艺的发展,指出了新的发展方向。因此,强调了从事膜和膜工艺设计和核废料处理的研究人员的共同努力。本文重点介绍了膜技术在核工业中的应用,并介绍了近年来膜技术在实验室、中试和工厂处理放射性废液方面的最新进展。正向渗透是放射性废物处理的重点,最近的一些出版物指出了它的潜力。我们的一些结果Bhabha原子研究中心,印度)关于膜为基础的过程也提出了。
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引用次数: 16
Self-forming Dynamic Membranes for Wastewater Treatment 用于废水处理的自形成动态膜
Pub Date : 2021-03-21 DOI: 10.1080/15422119.2021.1887223
J. Millanar-Marfa, L. Borea, F. Castrogiovanni, S. Hasan, K. Choo, G. Korshin, M. D. Luna, F. Ballesteros, V. Belgiorno, Vincenzo Naddeo
ABSTRACT Introduction Self-forming dynamic membrane (SFDM) technology has been gaining significant interest due to its potential advantages, notably lower capital and operational cost and easier fouling control, over conventional membranes used in membrane bioreactors. SFDM technology utilizes inexpensive support material integrated with a dynamic membrane (DM) made of suspended solids and biomass to provide high effluent quality. Objectives This paper aims to bridge the gap between the previous reviews and the current studies to provide a comprehensive review on SFDM applications to both aerobic and anaerobic bioreactors. Literature review The historical development of DMs since the 1960s up to the present is presented. Specific attention was given to DM formation mechanisms, deposition time, impacts of design, and operational factors (mesh characteristics and sludge properties) on DM formation and performances and on DM-based integrated systems. Abbreviations AnDMBR, anaerobic dynamic membrane bioreactor; CFV,crossflow velocity; COD,chemical oxygen demand; DM,dynamic membrane; DO,dissolved oxygen; EPS,extracellular polymeric substances; F/M,food to microorganisms ratio; HRT,hydraulic retention time; J,flux; MBR,membrane bioreactor; MF,microfiltration; MLSS,mixed liquor suspended solids; PSD,particle size distribution; RO,reverse osmosis; SEM,scanning electron microscopy; SFDM,self-forming dynamic membrane; SMP,soluble microbial products; SRT,sludge retention time; SS,suspended solids; TMP,transmembrane pressure; TN,total nitrogen; TP,total phosphorus; TSS,total suspended solids; UF,ultrafiltration
自形成动态膜(SFDM)技术由于其潜在的优势,特别是比膜生物反应器中使用的传统膜更低的资本和操作成本以及更容易的污染控制,已经获得了极大的兴趣。SFDM技术利用廉价的支撑材料与由悬浮固体和生物质制成的动态膜(DM)相结合,提供高质量的废水。本文旨在弥合以往研究和目前研究的差距,全面综述SFDM在好氧和厌氧生物反应器中的应用。文献综述介绍了自20世纪60年代至今的dm的历史发展。特别关注了DM的形成机制、沉积时间、设计和操作因素(网格特性和污泥特性)对DM形成和性能以及基于DM的集成系统的影响。AnDMBR,厌氧动态膜生物反应器;CFV横向气流速度;COD,化学需氧量;DM、动态膜;做,溶解氧;EPS,胞外聚合物质;F/M:食物与微生物比;HRT:液压停留时间;J,通量;MBR膜生物反应器;MF,微量过滤;MLSS,混合液悬浮物;PSD:粒度分布;RO反渗透;扫描电子显微镜;SFDM,自成型动态膜;SMP:可溶性微生物产物;SRT:污泥滞留时间;党卫军,悬浮物;TMP,跨膜压力;TN、总氮;TP,总磷;TSS:总悬浮固体;超滤,超滤
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引用次数: 12
Trends in the Direct and Indirect Chromatographic Determination of Organosulfur Compounds in Various Matrices 各种基质中有机硫化合物的直接色谱法和间接色谱法测定趋势
Pub Date : 2021-02-26 DOI: 10.1080/15422119.2020.1866011
S. Mgiba, V. Mhuka, N. Hintsho-Mbita, N. Mketo
ABSTRACT Organosulfur compounds (OSCs) are found in various matrices including fossil fuels, petrochemicals, food, environmental and biological samples. However, these OSCs can be beneficial or detrimental, depending on various factors. For example, OSCs found in vegetables have shown to be anti-inflammatory, antibiotic, lipid regulators and anti-cancer compounds. Additionally, OSCs found in alcoholic beverages enhance the aroma and taste. Alternatively, OSCs in fossil fuels can cause catalyst poisoning during fossil fuel processing which can result in H2S formation. The H2S can corrode processing machinery and liberate toxic sulfur emissions to the atmosphere, which then react with water to form harmful acid rain. Thus, monitoring concentration levels of OSCs in various samples is of interest. In this review, chromatographic analytical techniques that are mostly reported for both qualitative and quantitative determination of OSCs in various matrices are described based on direct (no sample preparation) and indirect (sample preparation needed) analyses. The merits and possible limitations associated with direct and indirect analyses are also discussed. Furthermore, the analytical performances of the various published sample preparation methods are evaluated in terms of accuracy, limit of detection and precision. Lastly, this review highlights current gaps in OSC chromatographic determination and possible future developments.
有机硫化合物(OSCs)存在于各种基质中,包括化石燃料、石化产品、食品、环境和生物样品。然而,这些osc可能是有益的,也可能是有害的,这取决于各种因素。例如,蔬菜中发现的OSCs已被证明是抗炎、抗生素、脂质调节剂和抗癌化合物。此外,在酒精饮料中发现的OSCs可以增强香气和味道。另外,化石燃料中的OSCs会在化石燃料加工过程中引起催化剂中毒,从而导致H2S的形成。硫化氢会腐蚀加工机械,并向大气中释放有毒的硫,然后与水反应形成有害的酸雨。因此,监测各种样品中OSCs的浓度水平是有意义的。在这篇综述中,色谱分析技术主要是基于直接(不需要样品制备)和间接(需要样品制备)分析来描述各种基质中OSCs的定性和定量测定。还讨论了直接分析和间接分析的优点和可能的局限性。此外,各种已发表的样品制备方法的分析性能在准确性,检出限和精密度方面进行了评估。最后,本文综述了盐盐色谱测定目前的差距和可能的未来发展。
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引用次数: 1
Polymer-based Membranes for Propylene/Propane Separation 丙烯/丙烷分离用聚合物基膜
Pub Date : 2021-02-26 DOI: 10.1080/15422119.2021.1874415
X. Chen, Anguo Xiao, D. Rodrigue
ABSTRACT Propane (C3H8) and propylene (C3H6) are important energy resources and raw materials for industrial chemistry. Today, propylene/propane separations are carried out by expensive distillation operations which are energy intensive. Therefore, there is a great interest in the development of new separation technologies like membrane modules. In this work, we collected and analyzed the data from neat polymers and mixed matrix membranes (MMM) for propylene/propane separations. Polymeric membranes are easily processed, but one important problem is plasticization since both propylene and propane are condensable gases resulting in a loss of selectivity. To improve the properties of polymer membranes, MMM were developed based on an inorganic filler and a polymer matrix to get improved performances with a synergistic effect. However, these performances strongly depend on the filler type and content, as well as their compatibility. In this review, the separation performances of neat polymers and MMM flat membranes and hollow fibers are reported. A comparison of the single gas and mixed gas permeation is presented where both permeability and selectivity are lost due to plasticization and the competitive sorption between gas molecules. Based on the results available, it can be concluded that more development can lead to improved performances for industrial-scale applications in the petroleum industries. Also, an upper bound for C3H6/C3H8 separation is proposed using neat polymers.
丙烷(C3H8)和丙烯(C3H6)是重要的能源资源和工业化学原料。今天,丙烯/丙烷的分离是通过昂贵的蒸馏操作进行的,这是能源密集型的。因此,人们对膜组件等新型分离技术的开发非常感兴趣。在这项工作中,我们收集并分析了用于丙烯/丙烷分离的整齐聚合物和混合基质膜(MMM)的数据。聚合物膜很容易加工,但一个重要的问题是塑化,因为丙烯和丙烷都是可冷凝气体,导致选择性损失。为了改善聚合物膜的性能,在无机填料和聚合物基体的基础上开发了MMM,以协同作用改善聚合物膜的性能。然而,这些性能很大程度上取决于填料的类型和内容,以及它们的兼容性。本文综述了整齐聚合物与MMM平面膜和中空纤维的分离性能。介绍了由于塑化作用和气体分子间的竞争性吸附而失去渗透性和选择性的单一气体渗透和混合气体渗透的比较。根据现有的结果,可以得出结论,更多的开发可以提高石油工业中工业规模应用的性能。同时,提出了用纯聚合物分离C3H6/C3H8的上界。
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引用次数: 9
Insisting upon Meaningful Results from Adsorption Experiments 坚持有意义的吸附实验结果
Pub Date : 2021-02-22 DOI: 10.1080/15422119.2021.1888299
M. Hubbe
ABSTRACT A rigorous approach to adsorption studies is advocated in this review article as a means to improving the experience of researchers and improving the practical value of published work in the field. Three broad areas of concern are considered in this article: mistakes related to the experimental conditions selected, mistakes related to modeling of results, and mistakes related to the mind-set of the investigators. Adsorption experiments can be perceived as an excellent training ground within which to hone the skills of researchers, including experimental methods, the use of statistics, and the ability to find suitable equations by referring to published literature. There is potential to increase the value to society of the results of such work by insisting upon the acquisition of truly meaningful results, in addition to accurately following research strategies laid out in published work. Examples related to adsorption onto cellulosic materials are emphasized in this article.
摘要:本文提出了一种严谨的吸附研究方法,以提高研究人员的经验和提高该领域已发表作品的实用价值。本文考虑了三个广泛的关注领域:与选择的实验条件有关的错误,与结果建模有关的错误,以及与研究人员思维方式有关的错误。吸附实验可以被看作是磨练研究人员技能的一个很好的训练基地,包括实验方法、统计数据的使用以及通过参考已发表的文献找到合适方程的能力。通过坚持获得真正有意义的结果,除了准确地遵循已发表的工作中提出的研究策略外,还有可能增加此类工作结果对社会的价值。本文着重介绍了纤维素材料吸附的实例。
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引用次数: 23
Activated carbon in mixed-matrix membranes 混合基质膜中的活性炭
Pub Date : 2021-01-02 DOI: 10.1080/15422119.2019.1609986
Jeremy Lewis, Maram A. Q. Al-sayaghi, Chris Buelke, A. Alshami
Mixed matrix membranes (MMMs) have emerged as strong contenders to conventional membranes for gas and liquid separations. Although numerous studies on filler/matrix combinations have been conducted and thoroughly reviewed, a review of activated carbon (AC) as a filler has thus far been minimal. This review intends to fill this gap via critically analyzing the state-of-the-art on AC as a filler in MMMs. Aspects of AC-MMM research, with emphasis on AC fabrication from biomass pyrolysis, AC-MMM fabrication and resulting properties, and influence of AC on MMM performance are thoroughly elucidated. Furthermore, the various applications that have been investigated with AC-MMM membranes, and several predictive models that have been specifically utilized for AC-MMMs are also discussed.
混合基质膜(MMMs)已成为传统膜在气体和液体分离领域的有力竞争者。尽管对填料/基质组合进行了大量的研究并进行了全面的审查,但迄今为止对活性炭(AC)作为填料的审查还很少。这篇综述旨在通过批判性地分析AC作为mm中填料的最新进展来填补这一空白。本文从生物质热解制备AC-MMM、AC-MMM的制备及其性能、AC对MMM性能的影响等方面深入阐述了AC-MMM研究的各个方面。此外,还讨论了AC-MMM膜的各种应用,以及专门用于AC-MMM的几种预测模型。
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引用次数: 17
Mathematical Modeling Aspect in Solvent Extraction of Metals 金属溶剂萃取的数学建模
Pub Date : 2021-01-02 DOI: 10.1080/15422119.2019.1648294
Swagatika Dash, S. Mohanty
This paper gives an overview of the major research carried out on mathematical modeling for solvent extraction of metals, primarily in the last one decade. The basic theory of solvent extraction as well as, the operational mechanism of various extractors (mixer-settler, column extractors, and liquid membranes) have been described. It discusses different approaches of mathematical modeling for studying solvent extraction of metals, starting from the simple empirical models to more rigorous transport phenomena models. Further, theoretical studies using molecular level modeling techniques such as molecular mechanics (MM), density functional theory, quantum mechanics/MM and Our own N-layered integrated molecular orbital and molecular mechanics (ONIOM) methods implemented for studying metal-ligand complexation have been reviewed.
本文概述了在溶剂萃取金属数学建模方面的主要研究,主要是在过去的十年中。介绍了溶剂萃取的基本原理,以及各种萃取器(混合沉降器、塔式萃取器和液膜萃取器)的工作机理。讨论了研究溶剂萃取金属的不同数学建模方法,从简单的经验模型到更严格的输运现象模型。此外,本文还综述了利用分子力学(MM)、密度泛函数理论、量子力学/MM和我们自己的n层集成分子轨道和分子力学(ONIOM)方法等分子水平建模技术研究金属配体络合的理论研究。
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引用次数: 8
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