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Cytotoxic activity properties of a benzimidazolium salt against lung, liver, and colon cancer cell lines 苯并咪唑盐对肺癌、肝癌和结肠癌细胞系的细胞毒活性特性
IF 3.2 4区 化学 Q2 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2024-10-22 DOI: 10.1016/j.jics.2024.101445
In this study, a known benzimidazolium salt was synthesized in two steps starting from N-phenyl-o-phenylenediamine. This compound was tested in vitro for 72 h against different cancer cell lines (A549 - lung cancer, HepG2 - liver cancer, DLD-1 - colon cancer) and to compare the activity of this compound with cisplatin, a widely used chemotherapeutic agent. The evaluation of compound 4 as a potential anticancer agent against different cancer types was achieved by examining the cytotoxic effects of this compound through IC50 values using the MTT method. It was found that compound 4 showed different activity depending on the cell type and had a high cytotoxic effect (IC50: 15.68 μM), especially against lung cancer cell line for 72 h incubation time.
本研究以 N-苯基邻苯二胺为起点,分两步合成了一种已知的苯并咪唑盐。该化合物针对不同的癌细胞株(A549-肺癌、HepG2-肝癌、DLD-1-结肠癌)进行了 72 小时的体外测试,并将其活性与广泛使用的化疗药物顺铂进行了比较。通过使用 MTT 法检测该化合物的细胞毒性作用 IC50 值,评估了化合物 4 作为潜在抗癌剂对不同癌症类型的作用。结果发现,化合物 4 在不同的细胞类型中表现出不同的活性,尤其是在 72 小时的培养时间内对肺癌细胞株具有较高的细胞毒性作用(IC50:15.68 μM)。
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引用次数: 0
Synthesis, characterization, and novel reactivity of nano CeO2 catalyst for solvent-free Knoevenagel condensation 用于无溶剂克诺文纳格尔缩合的纳米 CeO2 催化剂的合成、表征和新型反应活性
IF 3.2 4区 化学 Q2 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2024-10-20 DOI: 10.1016/j.jics.2024.101442
We synthesized the nano CeO2 using the sol-gel method and characterized the material using different techniques, including XRD, FT-IR, BET surface area, SEM, and TEM analysis. We tested the catalytic functionalities of nano CeO2 catalyst for Knoevengel condensation of different substituted benzaldehydes with malononitrile, which offered exceptional 95 % conversion and yield. The results support that nano CeO2 material significantly boosted the yield of the desired product compared to the bulk material. The low-angle XRD profile showed that the regenerated nanomaterial fully retained the porous nature and cubic structure of ceria. FT-IR results reveal that the characteristic vibrational IR band is at 720 cm−1, which is attributed to Ce–O–Ce stretching. The BET surface area result indicates that nano-ceria possesses a higher surface area than bulk CeO2 material. The SEM analysis illustrates cube-like morphology and TEM data show the nanorod-like appearance of ceria. The nanocatalyst exhibited stable and sustainable activity during regeneration up to 5 cycles.
我们采用溶胶-凝胶法合成了纳米 CeO2,并利用 XRD、FT-IR、BET 表面积、SEM 和 TEM 分析等不同技术对材料进行了表征。我们测试了纳米 CeO2 催化剂在不同取代苯甲醛与丙二腈的 Knoevengel 缩合反应中的催化功能,其转化率和产率高达 95%。结果表明,与块状材料相比,纳米 CeO2 材料显著提高了所需产物的产率。低角度 XRD 图谱显示,再生纳米材料完全保留了铈的多孔性和立方结构。傅立叶变换红外光谱(FT-IR)结果显示,特征振动红外波段位于 720 cm-1,属于 Ce-O-Ce 伸展。BET 比表面积结果表明,纳米铈比块状 CeO2 材料具有更高的比表面积。扫描电子显微镜(SEM)分析表明了铈的立方体形态,而 TEM 数据则显示了铈的纳米棒状外观。该纳米催化剂在再生过程中表现出稳定和持续的活性,可循环使用 5 次。
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引用次数: 0
Microbial depolymerization of Kraft lignin for production of Vanillic acid by indigenous ligninolytic strains 利用本地木质素分解菌株对牛皮纸木质素进行微生物解聚以生产香草酸
IF 3.2 4区 化学 Q2 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2024-10-18 DOI: 10.1016/j.jics.2024.101438
Lignin is a potential renewable source for the production of many value-added bio-products through bacterial depolymerization. In this study, Kraft lignin (KL) was depolymerized by indigenous potential ligninolytic strains to obtain the optimum amount of Vanillic acid. Initially, fifteen bacterial strains were isolated from decaying wood mixed soil to assess their lignin degradation efficiency. Five potential lignin-degrading microbes (RW-B2, RW-B4, RW-B9, RW-B11 and RW-B15) were identified by nutrient enrichment technique. RW-B15 was observed as a dominant strain sharing a 99 % resemblance to Bacillus megaterium sp. Optimum temperature and bacterial inoculum concentration were noted as 35 °C and 1 %, respectively. Mixed microbial culture of five potential ligninolytic strains showed better KL degradation than pure culture due to different metabolic capacities, enzymatic mechanisms and synergetic impact among the association members. The KL degradation study was conducted with different KL concentrations (500–2000 mg/l) at optimum temperature using 1 % inoculums. The production of Vanillic acid increased from 60.1 to 199.9 mg/l with increasing concentration of KL from 500 to 2000 mg/l. The maximum production of Vanillic acid was obtained on 3rd day of degradation and it decreased thereafter which is probably due to an increase in microbial toxicity and enzymatic activity. However, the COD level continuously decreased for all KL concentrations with degradation time till the last day. The pH of the KL solution slightly decreased on 3rd day due to the acidic nature of Vanillic acid. GC-MS analysis confirmed the presence of Vanillic acid and showed the presence of other monomeric compounds formed after KL degradation.
木质素是一种潜在的可再生资源,可通过细菌解聚作用生产多种高附加值的生物产品。在这项研究中,本地潜在的木质素分解菌株对牛皮纸木质素(KL)进行了解聚,以获得最佳量的香草酸。最初,从腐木混合土壤中分离出 15 种细菌菌株,以评估它们的木质素降解效率。通过营养富集技术,确定了五种潜在的木质素降解微生物(RW-B2、RW-B4、RW-B9、RW-B11 和 RW-B15)。最佳温度和细菌接种浓度分别为 35 °C 和 1%。五种潜在的木质素分解菌株的混合微生物培养显示出比纯培养物更好的 KL 降解效果,这是因为联合体成员之间的代谢能力、酶作用机制和协同影响各不相同。在最佳温度下,使用 1 % 的接种物对不同浓度(500-2000 mg/l)的 KL 进行了降解研究。随着 KL 浓度从 500 毫克/升到 2000 毫克/升的增加,香草酸的产量从 60.1 毫克/升增加到 199.9 毫克/升。香草酸的产量在降解的第三天达到最大值,之后有所下降,这可能是由于微生物毒性和酶活性的增加。然而,随着降解时间的延长,所有 KL 浓度的 COD 水平都持续下降,直到最后一天。由于香草酸呈酸性,KL 溶液的 pH 值在第三天略有下降。气相色谱-质谱分析证实了香草酸的存在,并显示了 KL 降解后形成的其他单体化合物的存在。
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引用次数: 0
A sustainable strategy to improve photocatalytic degradation properties of CuO and CuO-rGO nanocomposite using Eucalyptus leaf extract 利用桉树叶提取物改善 CuO 和 CuO-rGO 纳米复合材料光催化降解特性的可持续战略
IF 3.2 4区 化学 Q2 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2024-10-18 DOI: 10.1016/j.jics.2024.101423
In this study, Copper oxide (CuO) nanoparticles were synthesized using a sustainable approach. The process comprised Eucalyptus leaf extract as both a biological capping agent and a reducing agent. The synthesis process used a one-pot hydrothermal technique to efficiently combine CuO nanoparticles with reduced graphene oxide (rGO). Analytical methods were utilized to investigate the prepared nanocomposite's structural, crystalline, morphological, functional, optical, and thermal characteristics. The prepared sample was analyzed using X-ray diffraction, which revealed that CuO nanoparticles have a monoclinic crystal structure, and no impurity peaks were observed. Field emission scanning microscopes displayed the uniform dispersion of spherical CuO nanoparticles with layered and non-agglomerated, resembling a sponge-like structure of rGO. The microstructural analysis also confirmed the dispersion of copper inside reduced graphene oxide (rGO) sheets. The optical properties, including light absorption and bandgap width, were investigated using UV–visible spectroscopy using bandgap energies of 2.5 and 2.8 eV. In addition, the nanocomposite's ability to degrade cationic Rhodamine 6G and anionic Rose Bengal dyes by photocatalysis was evaluated. The degradation of RB and Rh6G dyes was characterized by nanocatalysis using UV–visible spectroscopy and a pseudo-first-order kinetics model. The pseudo-first-order degradation kinetic rate of Rhodamine 6G was determined to be 2.55 x 10−2 min−1, indicating that the nanocomposite effectively initiates this dye's degradation. The results showed that dye degradation was effective even at reduced catalyst concentrations.
本研究采用可持续方法合成了纳米氧化铜(CuO)颗粒。该工艺由桉树叶提取物作为生物封端剂和还原剂。合成过程采用一锅水热技术,有效地将氧化铜纳米粒子与还原型氧化石墨烯(rGO)结合在一起。利用分析方法研究了所制备纳米复合材料的结构、结晶、形态、功能、光学和热学特性。利用 X 射线衍射分析了制备的样品,结果表明 CuO 纳米粒子具有单斜晶体结构,且未观察到杂质峰。场发射扫描显微镜显示,球形 CuO 纳米粒子均匀分散,具有分层和无团聚的特点,类似于 rGO 的海绵状结构。微观结构分析也证实了铜在还原氧化石墨烯(rGO)片中的分散。利用带隙能量为 2.5 和 2.8 eV 的紫外可见光谱分析了其光学特性,包括光吸收和带隙宽度。此外,还评估了纳米复合材料通过光催化降解阳离子罗丹明 6G 和阴离子玫瑰红染料的能力。利用紫外可见光谱和伪一阶动力学模型对纳米催化降解 RB 和 Rh6G 染料的过程进行了表征。经测定,罗丹明 6G 的伪一阶降解动力学速率为 2.55 x 10-2 min-1,表明纳米复合材料能有效地启动该染料的降解。结果表明,即使在催化剂浓度降低的情况下,染料降解也是有效的。
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引用次数: 0
An insight into synergistic effect of polyaniline and noble metal (Ag) on vanadium pentoxide nanorods for enhanced energe storage performance 洞察五氧化二钒纳米棒上聚苯胺和贵金属(银)的协同效应以提高储能性能
IF 3.2 4区 化学 Q2 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2024-10-18 DOI: 10.1016/j.jics.2024.101440
The widespread applications of vanadium pentoxide (V2O5) are limited because of its low electrical conductivity and restricted ion diffusion coefficient. To address these constraints, the present study includes a straightforward and effective approach for fabricating polyaniline based silver-decorated vanadium pentoxide (Ag–V2O5/PANi) as an electrode material. The structural and morphological investigation of prepared electrode materials were made by X-ray diffraction analysis and scanning electron microscopy respectively. In comparison to pure Ag–V2O5, the Ag–V2O5/PANi composite demonstrated enhanced performance in various aspects. Specifically, the Ag–V2O5/PANi showed a higher specific capacitance (628 Fg−1) when subjected to a current density (1 Ag−1) in KOH electrolyte. Additionally, it has an energy density of 153 Whkg−1. Furthermore, the Ag–V2O5/PANi composite exhibited superior stability even after undergoing 3000 charge to discharge cycles. Exceptional capabilities shown can be ascribed to synergistic interaction between PANi and Ag–V2O5. The remarkable outcomes obtained from these electrode materials have the potential to foster novel prospects in high-energy-density storage systems.
由于五氧化二钒(V2O5)导电率低、离子扩散系数有限,因此其广泛应用受到了限制。针对这些制约因素,本研究采用一种简单有效的方法制备了聚苯胺基银装饰五氧化二钒(Ag-V2O5/PANi)电极材料。通过 X 射线衍射分析和扫描电子显微镜分别对所制备电极材料的结构和形态进行了研究。与纯 Ag-V2O5 相比,Ag-V2O5/PANi 复合材料的各方面性能都有所提高。具体来说,Ag-V2O5/PANi 在 KOH 电解液中的电流密度(1 Ag-1)下显示出更高的比电容(628 Fg-1)。此外,它的能量密度为 153 Whkg-1。此外,Ag-V2O5/PANi 复合材料在经历 3000 次充放电循环后仍表现出卓越的稳定性。PANi和Ag-V2O5之间的协同作用使其表现出卓越的性能。这些电极材料取得的卓越成果有望为高能量密度存储系统带来新的前景。
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引用次数: 0
Structural modulation in colored polymer bands of methacrylic acid-based frontal polymerization 基于甲基丙烯酸的正面聚合的彩色聚合物带的结构调制
IF 3.2 4区 化学 Q2 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2024-10-18 DOI: 10.1016/j.jics.2024.101437
The periodic colored polymer bands have been investigated in frontal polymerization (FP) reaction containing methacrylic acid (MAA), hydroquinone, Benzoyl peroxide (BP), and N, N Dimethyl aniline (DMA) system. The MAA acts as a monomer, which was diluted adequately with methanol (MeOH), ethanol (EtOH), and butanol (BuOH) separately to observe the patterning characteristics in different reaction schemes. The structural modulations that include the periodicity of colored polymer bands, morphological changes, and spacings between two adjacent layers were studied. The colored variations of polymer bands and their dependency on the concentration of BP, hydroquinone and alcoholic compositions have been studied. The highly consistent pink-white colored polymer bands, loosely-packed band structures, and perfectly ordered band structures resulted in MeOH, EtOH, and BuOH systems, respectively, as discussed. The evolution of tiny bubbles and convection-type instability has been observed in different conditions of the FP reactions that significantly affect the planar movement of the polymer fronts. The hot spots, which usually represent the high-temperature regions of a typical frontal surface, have also been demonstrated in all reacting systems, which may cause spin mode propagation of the fronts and change the surface geometry, as described. The materials characterization was carried out using UV–visible spectrophotometer, NMR, FTIR, and FESEM techniques, providing information about the polymer phases involved in band structures, composition, and surface properties. The analytical data and results obtained during the study further emphasized that two different colored polymers, namely 1, 4-dihydroxy anthraquinone methacrylic acid and poly-methacrylic acid dihydroxy, anthraquinone produced simultaneously and crystallized periodically, results in the development of a colored polymer band structures. The possible reactions and associated chemical mechanisms concerning the observations, the nature of the monomer, and solvent characteristics have been proposed, which show a close agreement with the analytical data and results obtained during the study.
在含有甲基丙烯酸(MAA)、对苯二酚、过氧化苯甲酰(BP)和 N,N 二甲基苯胺(DMA)体系的正面聚合(FP)反应中,研究了周期性彩色聚合物带。MAA 作为单体,分别用甲醇 (MeOH)、乙醇 (EtOH) 和丁醇 (BuOH) 充分稀释,以观察不同反应方案中的图案特征。研究内容包括彩色聚合物带的周期性、形态变化和相邻两层之间的间距等结构变化。研究了聚合物色带的颜色变化及其与 BP、对苯二酚和酒精成分浓度的关系。分别讨论了在 MeOH、EtOH 和 BuOH 体系中产生的高度一致的粉白色聚合物带、松散堆积的带结构和完全有序的带结构。在 FP 反应的不同条件下,观察到了微小气泡和对流型不稳定性的演变,这极大地影响了聚合物前沿的平面运动。热点通常代表典型锋面的高温区域,在所有反应体系中也都得到了证实,这可能会导致锋面的自旋模式传播并改变表面几何形状,如前所述。材料表征采用了紫外-可见分光光度计、核磁共振、傅立叶变换红外光谱和 FESEM 技术,提供了有关带状结构、成分和表面特性所涉及的聚合物相的信息。研究中获得的分析数据和结果进一步强调了两种不同的有色聚合物,即 1,4-二羟基蒽醌甲基丙烯酸和聚甲基丙烯酸二羟基蒽醌同时生产并定期结晶,从而形成了有色聚合物带状结构。研究人员提出了与观察结果、单体性质和溶剂特性有关的可能反应和相关化学机制,这些反应和机制与分析数据和研究过程中获得的结果非常吻合。
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引用次数: 0
Simple and robust method for the synthesis of Metopimazine by utilising smile’s rearrangement. Elimination of genotoxic impurities via derivatization 利用 smile's 重排法合成 Metopimazine 的简单而可靠的方法。通过衍生化消除基因毒性杂质
IF 3.2 4区 化学 Q2 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2024-10-18 DOI: 10.1016/j.jics.2024.101430
A simple, efficient and scalable methodology has been developed for the synthesis of Metopimazine, a dopamine D2–receptor antagonist. Starting from nitrophenylthio substituted methylsulfonyl benzenamine subjected to simple N–formylation using formic acid followed by base–catalysed cyclization resulted the formation of 2–(methylsulfonyl)–10H–phenothiazine. This method does not involve the conventional peracid oxidation that exemplifies the formation of several oxidized species that are tedious to separate. The later derivative is proven effective in the synthesis of title active pharmaceutical ingredient via N–chloroproylation followed by treating piperidine–4–carboxamide resulted in the formation of Metopimazine in high yield. The potential genotoxic impurities such as nitroaromatic derivatives were effectively removed by reduction using simple zinc dust formic acid treatment, which effectually converts nitro derivatives into amine hydrochlorides that are water soluble. Similarly, the N–alkylation of phenothiazine derivative forms potential impurities such as the formation of N–allyl and propyl bridged dimer derivatives that are removed by effective recrystallization. This method has been scaled up and evidenced no compromise with the yield and hence can be considered as industry ready.
我们开发了一种简单、高效和可扩展的方法来合成多巴胺 D2 受体拮抗剂 Metopimazine。从硝基苯硫代甲磺酰苯胺开始,使用甲酸进行简单的 N-甲酰化反应,然后在碱催化下进行环化反应,最终形成 2-(甲磺酰基)-10H-吩噻嗪。这种方法不涉及传统的过酸氧化反应,而过酸氧化反应会形成多种氧化物,分离起来非常麻烦。事实证明,后一种衍生物在合成标题活性药物成分时非常有效,先进行 N-氯丙基化反应,然后再处理哌啶-4-甲酰胺,这样就能以高产率生成美托咪嗪。硝基芳香族衍生物等潜在的基因毒性杂质通过使用简单的锌粉甲酸还原法有效去除,该方法可有效地将硝基衍生物转化为可溶于水的胺盐酸盐。同样,吩噻嗪衍生物的 N-烷基化也会产生潜在的杂质,如形成 N-烯丙基和丙基桥接二聚体衍生物,这些杂质可通过有效的重结晶去除。该方法已进行了放大,证明在产量方面没有受到任何影响,因此可被视为工业上的现成方法。
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引用次数: 0
Enhancement of optoelectronic properties of Vanadium nitride/porous silicon heterojunction photodetector prepared by electrochemical etching and reactive DC sputtering 通过电化学蚀刻和反应性直流溅射制备的氮化钒/多孔硅异质结光电探测器的光电性能提升
IF 3.2 4区 化学 Q2 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2024-10-18 DOI: 10.1016/j.jics.2024.101432
In this work, vanadium nitride (VN) thin films were deposited on porous silicon using the DC sputtering technique. The porous silicon was prepared using the electrochemical etching method at various current densities. X-ray diffraction (XRD), field emission scanning electron microscopy (FE-SEM), Fourier transform infrared (FTIR) spectroscopy, UV–visible spectrometry, and photoluminescence (PL) spectroscopy were used to study the structural, morphological, chemical, and optical characteristics of the vanadium nitride and porous silicon. X-ray diffraction studies showed that the deposited vanadium nitride film was crystalline in nature with a cubic structure. The VN particles were found to be embedded inside the pores of the porous silicon. The crystallite size of the VN film was 8 nm. The optical absorption results showed that the optical energy gap of vanadium nitride was 2.98 eV. The photoluminescence spectra revealed the presence of four emission peaks located at 441, 496, 541, and 720 nm. The electrical properties of the VN/PSi heterojunction, including dark and illuminated current-voltage characteristics as a function of etching current density, were investigated. The best ideality factor was 3.1 for heterojunction prepared at a current density of 8 mA/cm2. A responsivity of 3.7 A/W and a detectivity of 6.5 × 1011 Jones at 500 nm were found for the photodetector fabricated at a current density of 8 mA/cm2. The (I-t) response of the photodetectors were determined.
在这项工作中,使用直流溅射技术在多孔硅上沉积了氮化钒(VN)薄膜。多孔硅是采用电化学蚀刻法在不同电流密度下制备的。利用 X 射线衍射 (XRD)、场发射扫描电子显微镜 (FE-SEM)、傅立叶变换红外光谱 (FTIR)、紫外可见光谱法和光致发光 (PL) 光谱法研究了氮化钒和多孔硅的结构、形态、化学和光学特性。X 射线衍射研究表明,沉积的氮化钒薄膜是立方结构的晶体。氮化钒颗粒被嵌入多孔硅的孔隙中。氮化钒薄膜的晶体尺寸为 8 纳米。光吸收结果表明,氮化钒的光能隙为 2.98 eV。光致发光光谱显示,在 441、496、541 和 720 纳米波长处存在四个发射峰。研究了 VN/PSi 异质结的电学特性,包括暗电流和光照电流-电压特性与蚀刻电流密度的函数关系。在电流密度为 8 mA/cm2 时制备的异质结的最佳理想因子为 3.1。电流密度为 8 mA/cm2 时,光电探测器的响应率为 3.7 A/W,500 nm 时的检测率为 6.5 × 1011 Jones。光电探测器的(I-t)响应已经测定。
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引用次数: 0
Enhanced lead adsorption by eco-hydroxyapatite derived from marble sludge: Optimization and kinetic study 从大理石污泥中提取的生态羟基磷灰石增强了对铅的吸附:优化和动力学研究
IF 3.2 4区 化学 Q2 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2024-10-16 DOI: 10.1016/j.jics.2024.101421
In this study, eco-hydroxyapatite (e-HAP) was synthesized from marble sludge via a hydrothermal process for utilization as an adsorbent in the removal of Pb2+ ions from wastewater. X-ray powder diffraction (XRD) and thermal field emission scanning electron microscope (FE-SEM) revealed that increasing the Ca/P molar ratio (CPMR) and hydrothermal temperature (HT) increased crystallinity and that the influence of HT was more apparent. An increase in crystallinity, crystal length, and peak intensity was observed following an increase in the CPMR. Adsorption studies show that when the HT was 393 K, the CPMR was 0.67, the initial Pb2+ ion concentration was 100 mg/L, the equilibrium time was 20 min, and the adsorbent dosage was 0.6 g/L. The resulting removal efficiency (99.99 %) and maximum adsorption capacity (166.65 mg/g) are both very high. Adsorption kinetics are well described using a pseudo-second-order kinetic model. This paper presents a facile and economically sustainable approach to the synthesis of e-HAP from marble sludge for use in removing of Pb2+ from wastewater.
本研究以大理石污泥为原料,通过水热法合成了生态羟基磷灰石(e-HAP),并将其用作去除废水中 Pb2+ 离子的吸附剂。X 射线粉末衍射(XRD)和热场发射扫描电子显微镜(FE-SEM)显示,提高 Ca/P 摩尔比(CPMR)和水热温度(HT)可增加结晶度,而 HT 的影响更为明显。随着 CPMR 的增加,结晶度、晶体长度和峰值强度也随之增加。吸附研究表明,当 HT 为 393 K 时,CPMR 为 0.67,初始 Pb2+ 离子浓度为 100 mg/L,平衡时间为 20 分钟,吸附剂用量为 0.6 g/L。吸附剂的去除率(99.99 %)和最大吸附容量(166.65 mg/g)都非常高。使用伪二阶动力学模型对吸附动力学进行了很好的描述。本文提出了一种从大理石污泥中合成 e-HAP 的简便且经济上可持续的方法,可用于去除废水中的 Pb2+。
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引用次数: 0
Optimization, imaging and LHE analysis of magnesium oxide nanoparticles synthesized with carambola extract as natural dye sensitizer 用胡罗卜提取物合成的氧化镁纳米粒子作为天然染料敏化剂的优化、成像和 LHE 分析
IF 3.2 4区 化学 Q2 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2024-10-16 DOI: 10.1016/j.jics.2024.101434
This work explores the enhancement of dye-sensitized solar cells (DSSCs) by using magnesium oxide nanoparticles (MgO NPs) that have been green-synthesized, with carambola extract acting as a natural dye sensitizer. Green synthesis minimizes the negative effects of traditional synthesis methods on the environment by providing a sustainable and ecologically friendly way to produce MgO NPs. To increase their effectiveness in DSSC applications, the synthesized nanoparticles underwent optimization. The morphology and size distribution of MgO NPs were characterized by scanning electron microscopy (SEM), which revealed spherical forms with a consistent size distribution. The crystalline nature of the MgO NPs was verified by X-ray diffraction (XRD), which revealed distinctive peaks that correspond to the bulk MgO crystal planes. A band gap of 3.5 eV, appropriate for UV region absorption, was found using UV–visible spectroscopy. FT-IR (Fourier-transform infrared) spectroscopy revealed information about their molecular compositions. Positive electronic characteristics, such as a negative total energy change (ΔE_T) and a high electrophilicity index (ω), which indicates effective charge transfer, were found through computational analysis. The light harvesting efficiency (LHE) value of 0.00459 signifies optimal light absorption capability by the dye molecule. The outcomes show that MgO NPs that have undergone green synthesis have the potential to be efficient and stable sensitizers for DSSCs. In addition to highlighting the significance of green synthesis techniques in nanomaterial research for renewable energy applications, this work advances the development of efficient and sustainable solar energy systems.
这项研究探讨了如何利用绿色合成的氧化镁纳米粒子(MgO NPs)增强染料敏化太阳能电池(DSSC)的性能,苌楚提取物是一种天然染料敏化剂。绿色合成提供了一种可持续的生态友好型氧化镁纳米粒子生产方法,从而最大限度地减少了传统合成方法对环境的负面影响。为了提高其在 DSSC 应用中的有效性,对合成的纳米粒子进行了优化。通过扫描电子显微镜(SEM)对氧化镁 NPs 的形态和尺寸分布进行了表征,结果显示其呈球形,尺寸分布一致。氧化镁 NPs 的结晶性质通过 X 射线衍射 (XRD) 得到验证,XRD 显示了与块状氧化镁晶面相对应的独特峰值。利用紫外可见光谱发现了 3.5 eV 的带隙,适合紫外区吸收。傅立叶变换红外光谱(FT-IR)显示了它们的分子组成信息。通过计算分析发现了积极的电子特性,如负总能量变化(ΔE_T)和高亲电指数(ω),这表明电荷转移有效。光收集效率(LHE)值为 0.00459,表明染料分子具有最佳的光吸收能力。研究结果表明,经过绿色合成的氧化镁纳米粒子有望成为高效、稳定的 DSSC 感光剂。除了强调绿色合成技术在可再生能源应用纳米材料研究中的重要意义外,这项工作还推动了高效和可持续太阳能系统的发展。
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引用次数: 0
期刊
Journal of the Indian Chemical Society
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