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Investigation of the reaction of dimedone with aromatic aldehydes in the presence of copper oxide nanoparticles 氧化铜纳米颗粒存在下二甲基酮与芳香醛反应的研究
Q4 Materials Science Pub Date : 2024-07-10 DOI: 10.15826/chimtech.2024.11.3.03
Ravina Meena, H. Sachdeva
Variously substituted methylene bis(3-hydroxy-5,5-dimethyl-2-cyclohexene-1-one) derivatives were synthesized in 83–96% yield by the reaction of substituted benzaldehyde with 5, 5-dimethyl-1, 3-cyclohexanedione in the presence of CuO nanoparticles (NPs). Tandem grinding involves Knoevenagel condensation followed by the Michael addition in sequence for the formation of 2, 2’-arylmethylenebis (3-hydroxy-5, 5-dimethyl-2-cyclohexene-1-one) derivatives. Copper oxide NPs were synthesized by sol-gel method. The characterization of CuO NPs was done on the basis of PXRD, FTIR, SEM and TEM techniques. The synthesized derivatives were characterized on the basis of spectral analyses and corresponding melting points reported in the literature.
在 CuO 纳米粒子(NPs)存在下,通过取代苯甲醛与 5,5-二甲基-1,3-环己二酮反应,合成了各种取代亚甲基双(3-羟基-5,5-二甲基-2-环己烯-1-酮)衍生物,收率为 83-96%。串联研磨包括先进行 Knoevenagel 缩合,然后依次进行迈克尔加成,以形成 2,2'-芳基亚甲基双(3-羟基-5,5-二甲基-2-环己烯-1-酮)衍生物。氧化铜 NPs 采用溶胶-凝胶法合成。利用 PXRD、FTIR、SEM 和 TEM 技术对 CuO NPs 进行了表征。根据光谱分析和文献中报道的相应熔点对合成的衍生物进行了表征。
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引用次数: 0
Dispersive surface free energy of adsorbents modified by supramolecular structures of heterocyclic compounds 杂环化合物超分子结构改性吸附剂的分散表面自由能
Q4 Materials Science Pub Date : 2024-05-13 DOI: 10.15826/chimtech.2024.11.2.10
V. Yu. Guskov, Yulia Yu. Gainullina, Alina F. Gabdulmanova, Albina N. Gareeva
In the present work, the dispersive surface free energy was calculated by Dorris-Gray method for 30 samples of adsorbents modified with chiral supramolecular structures of uracil, 6-methyluracil, 5-hydroxy-6-methyluracil, 5-fluorouracil, thymine, melamine, cyanuric and barbirutic acids, and perylene-3,4,9,10-tetracarboxylic dianhydride. It was shown that the homologous series of n-alkanes is better suited for measuring dispersive surface free energy than the homologous series of alcohols. It was established that the classical Dorris-Gray method does not allow obtaining well interpretable data for the objects studied. This is due to a noticeable effect that inductive interactions of a polar surface as an inductor with nonpolar alkane molecules have on the calculated values. We suggested to modify the Dorris-Gray method, making it possible to obtain data on the dispersive component of the free energy of adsorption. It was shown that the changes in dispersive surface free energy as a result of the modification correlate well with data on the structure and properties of supramolecular ensembles of the modifiers used. The results obtained can be used to predict the enantioselectivity of chiral adsorbents.
本研究采用多里斯-格雷法计算了 30 种用手性超分子结构修饰的吸附剂样品的分散表面自由能,这些超分子结构包括尿嘧啶、6-甲基尿嘧啶、5-羟基-6-甲基尿嘧啶、5-氟尿嘧啶、胸腺嘧啶、三聚氰胺、三聚氰酸和巴比妥酸以及过烯-3,4,9,10-四羧酸二酐。研究表明,正构烷烃同系物比醇同系物更适合测量分散表面自由能。研究表明,经典的多里斯-格雷法无法获得所研究对象的可解释数据。这是由于极性表面作为感应器与非极性烷烃分子的感应相互作用对计算值产生了明显影响。我们建议修改 Dorris-Gray 方法,使其能够获得吸附自由能色散分量的数据。结果表明,修改后分散表面自由能的变化与所用改性剂超分子组合的结构和性质数据有很好的相关性。所得结果可用于预测手性吸附剂的对映选择性。
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引用次数: 0
Cationic amphiphilic meroterpenoids: synthesis, antibacterial, antifungal and mutagenic activity 阳离子两亲经络萜类化合物:合成、抗菌、抗真菌和诱变活性
Q4 Materials Science Pub Date : 2024-05-09 DOI: 10.15826/chimtech.2024.11.2.09
Alan Akhmedov, R. Gamirov, Yulia Panina, Alina Baklagina, Evgenia Sokolova, Pavel V Zelenikhin, Olga Babaeva, Vasily Babaev, D. Shurpik, I. Stoikov
In this research, using the thia-Michael reaction, cationic amphiphilic meroterpenoids containing fragments of mono- and sesquiterpenoids were synthesized. The bacteriostatic and fungistatic activity of synthesized meroterpenoids against the fungi Saccharomyces cerevisiae and Candida sp., Gram-positive (Staphylococcus aureus, Staphylococcus epidermidis) and Gram-negative (Salmonella typhimurium, Klebsiella pneumoniae, Pseudomonas aeruginosa) bacteria was studied. The compound containing the farnesyl fragment was most active against Saccharomyces cerevisiae (MIC 0.039 mg/mL), Candida sp. (MIC 0.078 mg/mL), Gram-positive bacteria Staphylococcus epidermidis (MIC 0.02 mg/mL) and Gram-negative Salmonella typhimurium (MIC 0.078 mg/mL). Besides, the Ames test demonstrated the absence of direct mutagenic action in all the studied compounds.
本研究利用噻-迈克尔反应合成了含有单萜和倍半萜片段的阳离子两亲经络萜类化合物。研究了合成的经皮类化合物对真菌酿酒酵母和念珠菌、革兰氏阳性菌(金黄色葡萄球菌、表皮葡萄球菌)和革兰氏阴性菌(鼠伤寒沙门氏菌、肺炎克雷伯菌、绿脓杆菌)的抑菌和杀真菌活性。含有法尼基片段的化合物对酿酒酵母(MIC 0.039 mg/mL)、念珠菌(MIC 0.078 mg/mL)、革兰氏阳性菌表皮葡萄球菌(MIC 0.02 mg/mL)和革兰氏阴性菌鼠伤寒沙门氏菌(MIC 0.078 mg/mL)的活性最强。此外,艾姆斯试验表明,所有研究化合物都不存在直接诱变作用。
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引用次数: 0
Photoelectrochemical properties of Pt- and Ir-modified graphitic carbon nitride 铂和铱改性氮化石墨碳的光电化学特性
Q4 Materials Science Pub Date : 2024-05-07 DOI: 10.15826/chimtech.2024.11.2.08
D. Markovskaya, Victoria A. Lomakina, E. Kozlova
In this work, the photoelectrochemical properties of g-C3N4 modified with Pt, Ir and Ir/Pt bimetallic co-catalysts were studied. All prepared photoelectrodes were tested in a two-electrode cell by cyclic voltammetry, impedance spectroscopy, and the Mott-Schottky method. First, the optimal electrolyte (triethanolamine, NaCl, NaOH, Na2SO4) was selected. The highest photocurrents were recorded in 0.5 M Na2SO4. This electrolyte was used for the subsequent tests. Second, the photoelectrodes loaded with the noble metals are studied. It was shown that in case of monometallic co-catalysts, the deposition of noble metal is accompanied by the decrease of the short-circuit current density and the growth of open-circuit voltage. The simultaneous presence of bimetallic co-catalysts can significantly affect the semiconductor electron structure and photogalvanic properties. Some correlations between the short-circuit current density and the oxidation state of the noble metals were found. A linear correlation between Pt0/Pt0+Pt2+ and Jsc was observed. It was also shown that the presence of iridium in Ir3+ form favors the photocurrent generation. The highest values of the photocurrent were obtained for g-C3N4 and were equal to 0.57 mA/cm2.
在这项工作中,研究了用铂、铱和铱/铂双金属共催化剂修饰的 g-C3N4 的光电化学特性。所有制备的光电电极都在双电极电池中通过循环伏安法、阻抗光谱法和莫特-肖特基法进行了测试。首先,选择了最佳电解质(三乙醇胺、NaCl、NaOH、Na2SO4)。在 0.5 M Na2SO4 中记录到的光电流最高。随后的测试都使用了这种电解液。其次,研究了负载贵金属的光电极。研究表明,在单金属助催化剂中,贵金属的沉积伴随着短路电流密度的降低和开路电压的增长。双金属助催化剂的同时存在会显著影响半导体电子结构和光电耦合特性。研究还发现了短路电流密度与贵金属氧化态之间的一些相关性。观察到 Pt0/Pt0+Pt2+ 与 Jsc 之间存在线性关系。研究还表明,Ir3+形态的铱有利于光电流的产生。g-C3N4 的光电流值最高,为 0.57 mA/cm2。
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引用次数: 0
Features of electronic states in the vicinity of band gap and atomic structure of Ta- and Nb-doped Li7La3Zr2O12 掺钽和掺铌 Li7La3Zr2O12 带隙附近的电子态特征和原子结构
Q4 Materials Science Pub Date : 2024-05-06 DOI: 10.15826/chimtech.2024.11.2.07
M.I. Vlasov, E.A. Surzhikov, A. Germov, E. Il'ina, I. A. Weinstein
Li7La3Zr2O12 is one the most promising materials for Li-conducting solid electrolytes. The incorporation of Ta5+ and Nb5+ into the Zr4+ sites stabilizes its cubic structure and significantly enhances Li-conductivity, due to the formation of Li vacancies. In this research, we have studied the band gap features of Ta and Nd-doped Li7La3Zr2O12. Our findings indicate that Nb ions are present not only in the +5 valence state, but also in the +4 state, leading to the formation of oxygen vacancies. In the case of the Ta-doping, such an effect was not observed. This could be the reason for the approximately one order of magnitude higher lithium conductivity observed in the case of the Ta doping, in comparison to the Nb doping.
Li7La3Zr2O12 是最有前途的锂导电固体电解质材料之一。在 Zr4+ 位点中掺入 Ta5+ 和 Nb5+ 可稳定其立方结构,并由于锂空位的形成而显著提高锂导电性。在这项研究中,我们研究了掺杂 Ta 和 Nd 的 Li7La3Zr2O12 的带隙特征。我们的研究结果表明,铌离子不仅存在于 +5 价态,还存在于 +4 态,从而导致氧空位的形成。在掺杂 Ta 的情况下,没有观察到这种效应。这可能就是掺杂 Ta 的锂导电性比掺杂 Nb 的锂导电性高出约一个数量级的原因。
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引用次数: 0
CNT thin films based on epoxy mixtures: fabrication, electrical characteristics 基于环氧混合物的碳纳米管薄膜:制造、电气特性
Q4 Materials Science Pub Date : 2024-04-10 DOI: 10.15826/chimtech.2024.11.2.05
T. Yumalin, Timur Salikhov, Biltu Mahato, Alexey Shiverskii, Sergey Abaimov, R. Salikhov
The simple scaling of silicon transistors no longer ensures the advantages of high energy efficiency, driving research into nanotechnologies beyond silicon. Specifically, digital circuits based on carbon nanotube (CNT) field-effect transistors promise significant advantages in energy efficiency. However, the inability to perfectly control internal nanoscale defects and the variability of carbon nanotubes hinder the realization of very large-scale integrated systems. In this study, we investigated a novel method for fabricating transistors based on carbon nanotubes (CNTs) using epoxy mixtures, obtained the electrical properties of the transistors, and compared their microstructure and composition via the scanning electron microscopy. The carrier mobility on epoxy-based transistors was 28.87 cm²/V∙s, and the transistor switching frequency was 2.2 MHz. The samples exhibited electrical and physical stability over an extended period of time. The use of carbon nanotubes in epoxy resin as a conducting layer for transistors opens significant prospects in the field of electronics. The CNT-epoxy mixture technology allows for more flexible and rapid fabrication of thin-film transistors compared to classical methods. However, it is not appropriate to speak of a complete replacement; in this study, we present an alternative method for producing thin-film transistors, which may be of interest for specific purposes.
硅晶体管的简单扩展不再能确保高能效的优势,这推动了对硅以外的纳米技术的研究。具体而言,基于碳纳米管(CNT)场效应晶体管的数字电路有望在能效方面取得显著优势。然而,无法完美控制内部纳米级缺陷以及碳纳米管的可变性阻碍了大规模集成系统的实现。在本研究中,我们研究了一种使用环氧混合物制造基于碳纳米管(CNTs)的晶体管的新方法,获得了晶体管的电学特性,并通过扫描电子显微镜比较了晶体管的微观结构和组成。环氧基晶体管的载流子迁移率为 28.87 cm²/V∙s,晶体管开关频率为 2.2 MHz。样品在较长时间内表现出电气和物理稳定性。在环氧树脂中使用碳纳米管作为晶体管的导电层为电子学领域开辟了广阔的前景。与传统方法相比,碳纳米管-环氧树脂混合物技术可以更灵活、更快速地制造薄膜晶体管。然而,完全取代传统方法并不合适;在本研究中,我们提出了一种生产薄膜晶体管的替代方法,可能会对特定用途产生兴趣。
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引用次数: 0
Evaluation of electrochemical performance of antimony modified screen-printed carbon electrodes 评估锑改性丝网印刷碳电极的电化学性能
Q4 Materials Science Pub Date : 2024-04-09 DOI: 10.15826/chimtech.2024.11.2.04
Alexander B. Kifle, N. Malakhova, A. Ivoilova, Nataliya Leonova, Svetlana Saraeva, A. Kozitsina
This study compares the electrochemical performance of screen-printed carbon electrodes (SPCEs) modified with antimony (Sb/SPCEs) under different potentiostatic pre-plating conditions. Neutral Red (NR) was employed as a novel redox probe to evaluate the electrochemical performance of Sb/SPCEs. It was demonstrated that NR in the protonated form performs quasi-reversible redox transformations at bare SPCE and Sb/SPCEs in phosphate buffer solutions (pH 5.5±0.5) in the potential range of (−0.30)–(−0.75) V, where the antimony is not electroactive. Sb/SPCEs were studied electrochemically by cyclic voltammetry (CV) / electrochemical impedance spectroscopy (EIS), and morphologically by scanning electron microscopy (SEM). Cyclic voltammetry investigations revealed the dependence of the electrochemical performance of Sb/SPCEs on the degree of coverage of the substrate with the metal. The obtained CV, EIS, and SEM data are consistent. The lowest charge transfer resistance (Rct) value (6 Ω) was obtained at Sb/SPCE with the highest degree of antimony coverage. To investigate the electroanalytical performance of Sb/SPCEs, nickel (II) ions were utilized as a model analyte. A study of roughness factors and sensitivity towards nickel (II) ions for Sb/SPCEs using two-tailed Pearson's criterion revealed a high degree of correlation between their electrochemical and electroanalytical properties. The results show that using NR as a redox probe can help controlling modification processes during the development of innovative antimony-containing sensors.
本研究比较了不同电位静电预镀条件下用锑修饰的丝网印刷碳电极(SPCE)(Sb/SPCE)的电化学性能。采用中性红(NR)作为新型氧化还原探针来评估 Sb/SPCE 的电化学性能。研究表明,质子化形式的 NR 在磷酸盐缓冲溶液(pH 值为 5.5±0.5)中的裸 SPCE 和 Sb/SPCE 上发生了准可逆的氧化还原转变,电位范围为 (-0.30)-(-0.75) V,其中锑不具有电活性。通过循环伏安法(CV)/电化学阻抗谱法(EIS)对锑/SPCE 进行了电化学研究,并通过扫描电子显微镜(SEM)对其形态进行了研究。循环伏安法研究表明,Sb/SPCEs 的电化学性能取决于金属对基底的覆盖程度。所获得的 CV、EIS 和 SEM 数据是一致的。锑覆盖度最高的 Sb/SPCE 的电荷转移电阻 (Rct) 值(6 Ω)最低。为了研究 Sb/SPCE 的电分析性能,使用了镍(II)离子作为模型分析物。使用双尾皮尔逊标准对 Sb/SPCE 的粗糙度系数和对镍(II)离子的灵敏度进行的研究表明,它们的电化学和电分析性能之间存在高度相关性。结果表明,在开发创新型含锑传感器的过程中,使用 NR 作为氧化还原探针有助于控制改性过程。
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引用次数: 0
Effect of carbon black from Ageratina adenophora and various other carbon anode plate additives on the performance of lead acid batteries Ageratina adenophora 炭黑和其他各种炭阳极板添加剂对铅酸电池性能的影响
Q4 Materials Science Pub Date : 2024-04-08 DOI: 10.15826/chimtech.2024.11.2.03
Subban Ravi, Baskaran Vignesh, Nagarajan Meimoorthy, Bharathamani Dhanus Kumar, Lakshmanan Sathishkumar, Nagarajan Mohankumar, Nagarajan Kannapiran
The incorporation of carbon materials in batteries serves to enhance its performance by improving conductivity, achieving uniform active material distribution, increasing capacity, mitigating sulfation, extending cycle life, and considering potential environmental benefits. Even though several possible mechanisms were reported, how exactly carbon works is not fully understood. In the present study a new form of carbon black was prepared from Ageratina adenophora (CBAa) and investigated for its impact on the electrical conductivity of the negative active material in 2 V lead acid cell. The performance was compared with other commercially available carbons like Graphite PG-10, Carbon N550, Carbon N330 and Carbon Vulcan. The carbon was characterised by XRD, SEM and grain size analysis. The initial capacity of the cell was consistently higher and remained stable at 4.6 W∙h; in the life cycle analysis, the cells showed 290 cycles. The post-life cycle test analysis showed that only a white layer on multiple plates indicating the onset of sulfation and there is no corrosion. The performance of the CBAa prepared in the present work was found to be better when compared with the commercially available carbons.
在电池中加入碳材料可通过改善导电性、实现活性材料的均匀分布、增加容量、减轻硫酸盐化、延长循环寿命以及考虑潜在的环境效益来提高电池性能。尽管已经报道了几种可能的机制,但人们对碳究竟是如何起作用的并不完全了解。本研究从 Ageratina adenophora(CBAa)中制备了一种新型炭黑,并研究了它对 2 V 铅酸电池负极活性材料导电性的影响。将其性能与石墨 PG-10、碳 N550、碳 N330 和碳 Vulcan 等其他市售碳进行了比较。通过 XRD、SEM 和晶粒度分析对碳进行了表征。电池的初始容量一直较高,并稳定在 4.6 W∙h 的水平;在生命周期分析中,电池循环了 290 次。寿命周期后的测试分析表明,多块电池板上只有白色层,表明硫化开始,没有腐蚀。与市售碳相比,本研究制备的 CBAa 性能更佳。
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引用次数: 0
A review on agrowaste based activated carbons for pollutant removal in wastewater systems 基于农业废弃物的活性炭在废水系统中去除污染物的综述
Q4 Materials Science Pub Date : 2024-04-04 DOI: 10.15826/chimtech.2024.11.2.02
K. Okiy, Joseph Nwabanne Tagbo, Walter Peter Echeng
Environmental pollution from chemicals utilized in manufacturing, pharmaceuticals, and chemical process industries is of serious concern nowadays due to the contamination that ensues when these chemicals are discharged into water bodies. Activated carbon adsorption provides an efficient and economically viable means for mitigation of toxic chemicals (i.e., heavy metals, dyes, pharmaceutics, and antibiotics). However, the exorbitant cost of commercial activated carbons has resulted in the search for low-cost alternatives for the treatment of contaminated effluents. An exhaustive literature survey in this area is necessary to know the extent of work done in this area and seek out the gaps that future research will provide answers to. In this review, various works on activated carbon utilization, batch adsorption, fixed-bed adsorption (experimental and numerical studies) are summarized. This review elucidates the different kinetic and isotherm models of agrowastes-derived activated carbon materials in context with pollutants (dyes, heavy metals, pharmaceuticals, miscellaneous adsorbates) removal through batch and column methods. In addition, fixed-bed column adsorption/regeneration methods using various activated carbons derived from agrowastes are discussed. Among these methods, heavy metal adsorption from aqueous solutions by the activated carbons is the most efficient. The deployment of mathematical and machine learning approaches (ANN and novel GMDH algorithms) in optimization of batch and continuous adsorption processes are also highlighted. Numerical simulation of fixed-column adsorption systems for more improved industrial-scale column designs is described. Conclusions and future challenges of chemicals removal from polluted wastewater utilizing agrowaste-derived activated carbons are also presented.
如今,制造业、制药业和化学加工业所使用的化学物质对环境造成的污染已引起人们的严重关注,因为这些化学物质排入水体后会造成污染。活性炭吸附技术为减轻有毒化学物质(如重金属、染料、药物和抗生素)的污染提供了一种高效且经济可行的方法。然而,由于商用活性炭的价格昂贵,人们开始寻找低成本的替代品来处理受污染的污水。有必要对这一领域进行详尽的文献调查,以了解这一领域的工作程度,并找出差距,为今后的研究提供答案。本综述总结了有关活性炭利用、间歇吸附、固定床吸附(实验和数值研究)的各种工作。本综述阐明了农业废弃物衍生活性炭材料的不同动力学和等温线模型,并结合批次和柱吸附法去除污染物(染料、重金属、药物、其他吸附物)的情况进行了分析。此外,还讨论了使用各种农产废弃物衍生活性炭的固定床柱吸附/再生方法。在这些方法中,活性碳从水溶液中吸附重金属的效率最高。此外,还重点介绍了数学和机器学习方法(ANN 和新型 GMDH 算法)在优化批量和连续吸附过程中的应用。还介绍了固定柱吸附系统的数值模拟,以改进工业规模的吸附柱设计。此外,还介绍了利用源自农业废弃物的活性碳从污染废水中去除化学品的结论和未来挑战。
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引用次数: 0
Effects of coagulant bath temperature toward separation performance and antifouling properties of PVDF/CA membranes for filtration of dyes 混凝剂浴温度对用于染料过滤的 PVDF/CA 膜的分离性能和防污性能的影响
Q4 Materials Science Pub Date : 2024-04-01 DOI: 10.15826/chimtech.2024.11.2.01
Muhammad Reza, R. Rahmayani, C. Radiman
Phase inversion is used to prepare poly(vinylidene fluoride) (PVDF) microfiltration membranes by combining it with the hydrophilic polymer additive cellulose acetate (CA). For the filtration of methylene blue (MB) and acid yellow 17 (AY17), the effects of coagulant bath temperature (CBT) on the separation performance and antifouling properties are thoroughly investigated. SEM analysis shows that the membrane at higher CBT has a larger pore diameter than at lower CBT, resulting in differences in membrane surface hydrophilicity. It is found that the increase in surface hydrophilicity causes the permeability of PVDF/CA membranes to be higher at higher CBT than at lower CBT. Rejection values above 90% indicate that the membranes are more effective for MB separation at both lower and higher CBT. Otherwise, lower CBT provides better AC rejection than higher CBT. The Flux Recovery Ratio, which is higher at higher CBT, remains in the 75–95% range at lower CBT. As a result, lower CBT is better for membrane fouling resistance than higher CBT. In addition, the fouling observed at lower CBT is similar to the fouling observed at higher CBT, but lower CBT has a higher percentage of reversible fouling than higher CBT. The membranes with more reversible fouling are therefore easier to clean using the backwashing process. As a result, PVDF/CA membranes manufactured at lower CBT have better separation performance and antifouling characteristics than those manufactured at higher CBT.
通过将相反转与亲水性聚合物添加剂醋酸纤维素(CA)相结合,制备了聚(偏氟乙烯)(PVDF)微滤膜。针对亚甲基蓝(MB)和酸性黄 17(AY17)的过滤,深入研究了混凝剂槽温度(CBT)对分离性能和防污性能的影响。扫描电子显微镜分析表明,与较低的 CBT 相比,CBT 较高的膜孔径更大,导致膜表面亲水性不同。研究发现,表面亲水性的增加导致 PVDF/CA 膜在较高 CBT 下的渗透率高于较低 CBT 下的渗透率。剔除值超过 90% 表明,在较低和较高的 CBT 下,膜对甲基溴分离都更有效。否则,较低的 CBT 比较高的 CBT 能提供更好的交流抑制。通量回收率在 CBT 较高时较高,但在 CBT 较低时仍保持在 75-95% 的范围内。因此,较低的 CBT 比较高的 CBT 对膜防污效果更好。此外,在较低的 CBT 下观察到的污垢与在较高的 CBT 下观察到的污垢相似,但较低的 CBT 比较高的 CBT 有更高比例的可逆污垢。因此,可逆污垢较多的膜更容易使用反冲洗工艺进行清洗。因此,在较低 CBT 下制造的 PVDF/CA 膜比在较高 CBT 下制造的膜具有更好的分离性能和防污特性。
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引用次数: 0
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Chimica Techno Acta
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