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Preparation, in vitro and in silico antioxidant and antibacterial studies of 4-aminoacetanilide azo derivatives 4- 氨基乙酰苯胺偶氮衍生物的制备、体外及硅学抗氧化和抗菌研究
IF 3.2 4区 化学 Q2 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2024-09-05 DOI: 10.1016/j.jics.2024.101341

A new series of new 4-aminoacetanilide azo derivatives 113 were successfully synthesised via a diazo coupling reaction and gave a good to excellent yield of 73 %–93 %. The antioxidant capabilities of the series 113 screened through 2,2′-diphenyl-1-picrylhydrazyl (DPPH) assay and ferric reducing antioxidant power (FRAP) assay showed promising data of 12.6–199.4 ppm and 12.65–210.9 mg/ml Trolox equivalent, respectively. The findings supported by in silico docking analysis targeted Heme oxygenase-1 (HO-1) evidenced by a binding score of – 7.2 to – 8.2 kcal/mol outperforming the standard, ascorbic acid scoring only – 5.7 kcal/mol. Among all, compound 11 displayed the highest antioxidant potential with IC25 of 12.6 ppm against DPPH assay and 210.9 mg/ml Trolox for FRAP assay believed owing to the presence of methoxy group at ortho position in the phenolic compound that effectively lowered the ionisation potential and high up energy of highest occupied molecular orbital (HOMO). Nevertheless, the antibacterial potential of the series screened through the Kirby-Bauer disc diffusion method against Escherichia coli and Staphylococcus aureus showed no antibacterial activity postulated due to the presence of amide and acetyl group restricted the ability of the compound to form an interaction with the protein receptor of bacteria tested. This study provided new insight into the development of dual-functional drugs for non-communicable diseases and antimicrobial resistance.

通过重氮偶联反应,成功合成了一系列新的 4-氨基乙酰苯胺偶氮衍生物 1-13,收率为 73 %-93 %,达到良好至极佳水平。通过 2,2′-二苯基-1-苦基肼(DPPH)测定法和铁还原抗氧化力(FRAP)测定法对 1-13 系列衍生物的抗氧化能力进行了筛选,结果显示其抗氧化能力分别为 12.6-199.4 ppm 和 12.65-210.9 mg/ml Trolox 当量。这些发现得到了针对血红素加氧酶-1(HO-1)的硅学对接分析的支持,其结合得分为 - 7.2 至 - 8.2 kcal/mol,优于标准的抗坏血酸,后者的结合得分仅为 - 5.7 kcal/mol。在所有化合物中,化合物 11 的抗氧化潜力最高,对 DPPH 法的 IC25 值为 12.6 ppm,对 FRAP 法的 IC25 值为 210.9 mg/ml Trolox。然而,通过柯比鲍尔碟片扩散法对大肠杆菌和金黄色葡萄球菌进行的抗菌潜力筛选表明,该系列化合物没有抗菌活性,这可能是由于酰胺基和乙酰基的存在限制了化合物与受试细菌的蛋白质受体形成相互作用的能力。这项研究为开发治疗非传染性疾病和抗菌药耐药性的双功能药物提供了新的视角。
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引用次数: 0
Thiosemicarbazone-based Dioxomolybdenum (VI) complexes as inorganic nucleases 作为无机核酸酶的硫代氨基羰基二氧钼 (VI) 复合物
IF 3.2 4区 化学 Q2 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2024-09-05 DOI: 10.1016/j.jics.2024.101361
This study focuses on the design of alkyl-substituted thiosemicarbazones from 5-bromosalicylaldehyde and substituted thiosemicarbazides and the corresponding dioxomolybdenum(VI) complexes, hitherto unreported. In addition to elemental analyses, the synthesized ligands and the corresponding complexes are further analyzed by physico-chemical and spectroscopic techniques. The DNA interaction studies are based on UV absorption titration and gel electrophoretic methods. The binding constants (Kb) for the ligands (L1-L4) are found to be 1.20 ± 0.1 × 104 M−1; 1.32 ± 0.2 × 104 M−1; 1.27 ± 0.3 × 104 M−1 and 1.25 ± 0.3 × 104 M−1 respectively and that of the complexes (C1–C4) are 1.45 ± 0.2 × 104 M−1; 2.10 ± 0.4 × 104 M−1; 1.54 ± 0.2 × 104 M−1 and 2.13 ± 0.2 × 104 M−1, respectively. The complexes have shown relatively higher binding propensity as compared to that of the ligands. Further, as the outcome of gel electrophoresis studies, the ligands show a cleavage pattern of nicked circular (Form I). However, the complexes show cleavage patterns of both nicked circular and supercoiled, Forms I & II respectively. This implies that both the ligands and complexes possess varying binding efficacy with DNA and accordingly the cleavage patterns also differ.
本研究侧重于从 5-溴水杨醛和取代的硫代氨基甲酸烷基酯中设计出烷基取代的硫代氨基甲酸烷基酯以及相应的二噁钼(VI)配合物。除了元素分析之外,还通过物理化学和光谱技术对合成的配体和相应的配合物进行了进一步分析。DNA 相互作用研究基于紫外吸收滴定法和凝胶电泳法。发现配体(L1-L4)的结合常数(Kb)分别为 1.20 ± 0.1 × 104 M-1;1.32 ± 0.2 × 104 M-1;1.27 ± 0.3 × 104 M-1 和 1.25 ± 0.复合物(C1-C4)的结合力分别为 1.45 ± 0.2 × 104 M-1;2.10 ± 0.4 × 104 M-1;1.54 ± 0.2 × 104 M-1 和 2.13 ± 0.2 × 104 M-1。与配体相比,复合物显示出更高的结合倾向。此外,凝胶电泳研究结果表明,配体显示出缺口环状(形式 I)的裂解模式。然而,复合物的裂解模式既有切口环状的,也有超卷曲的,分别为形式 I & II。这意味着配体和复合物与 DNA 的结合效力不同,因此裂解模式也不同。
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引用次数: 0
Study on chemical modification of locust bean gum for enhanced functionality 关于对槐豆胶进行化学改性以增强其功能的研究
IF 3.2 4区 化学 Q2 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2024-09-04 DOI: 10.1016/j.jics.2024.101360

The present study focused on modifying Locust bean gum (LBG) to alter its physical properties, including hydration and cold-water solubility. The chemical modification process for LBG was optimized for scalability by adjusting the reaction medium and mixture of ethanol and water in a ratio of 60:40. The optimized reaction medium had a sufficient amount of water, which allowed the uncoiling of the chains and aided in the scalability of the process. The LBG was subjected to acid modification using various acids with and without the addition of sodium bicarbonate. Results revealed that LBG modified with HCl exhibited enhanced crystallinity, reduced water absorption by 2 folds, reduction in emulsion stability by 20 %, and superior hydrophobicity in comparison to control LBG majorly due to the change in mannose to galactose ratio (9.1:1). On the other hand, the sodium salt of modified LBG exhibited greater amorphousness, increased solubility by 20 %, and a remarkable ∼7-fold increase in surface area. Additionally, there was a ∼5-fold drop in the average pore diameter compared to the control LBG. These results demonstrate the potential for chemical modifications to modify the physical properties of LBG for specific applications.

本研究的重点是对槐豆胶(LBG)进行改性,以改变其物理特性,包括水合性和冷水溶解性。通过调整反应介质以及乙醇和水的混合比例(60:40),对蚕豆胶的化学改性过程进行了可扩展性优化。优化后的反应介质有足够的水量,这使得链条可以松开,有助于工艺的可扩展性。在添加或不添加碳酸氢钠的情况下,使用各种酸对枸杞多糖进行酸改性。结果显示,与对照 LBG 相比,用盐酸改性的 LBG 表现出更高的结晶度,吸水性降低了 2 倍,乳液稳定性降低了 20%,疏水性更好,这主要是由于甘露糖与半乳糖的比例发生了变化(9.1:1)。另一方面,改性枸杞多糖的钠盐表现出更大的无定形性,溶解度增加了 20%,表面积显著增加了 7 倍。此外,与对照 LBG 相比,平均孔径下降了 5 倍。这些结果证明了化学改性在改变枸杞多糖的物理性质以满足特定应用需求方面的潜力。
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引用次数: 0
Facile synthesis of Tl, Pb, and Bi doped CeO2 nanoparticles and the evaluation of their in-vitro cytotoxicity and photocatalytic performance 掺杂 Tl、Pb 和 Bi 的 CeO2 纳米粒子的简易合成及其体外细胞毒性和光催化性能评估
IF 3.2 4区 化学 Q2 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2024-09-03 DOI: 10.1016/j.jics.2024.101350

Our work attempted a green route for provisioning of thallium, lead, and bismuth into cerium oxide nanoparticles (Tl, Pb, and Bi–CeO2 NP) via the application of Alhagi maurorum. We configured the physicochemical attributes of procured NPs via PXRD, Raman, FESEM/PSA/EDX, and UV–Vis/DRS assessments. Attendance of doped metals in structure of CeO2 was confirmed by outcomes of PXRD and EDX analyses. Next to the porous morphology, FESEM images also demonstrated the induced alterations in particle size after the doping of different metals. We also tested the photocatalytic function of synthesized NP on Methylene blue (MB) dye on UV light, which displayed the superior degradation functionality of Tl–CeO2 NP. The toxicity function of synthesized pure and Tl, Pb, and Bi–CeO2 NP on breast cancer cell (MDA-MB-231) and breast normal cell (MCF-10 A) lines was considered through the results of MTT trial. The outcomes of synthesized NPs displayed no signs of any cytotoxic effects against MCF-10 A and MDA-MB-231 cells, which signified the creation of non-toxic nanoparticles by the introduced doping process. Therefore, we suggest the applicability of our product in drug delivery systems and also industrial implementations similar to dye photodegradation and annihilation of pollution.

我们的研究尝试了一条绿色途径,通过应用 Alhagi maurorum 将铊、铅和铋添加到氧化铈纳米粒子(Tl、Pb 和 Bi-CeO2 NP)中。我们通过 PXRD、拉曼、FESEM/PSA/EDX 和 UV-Vis/DRS 评估配置了获得的 NP 的物理化学属性。PXRD 和 EDX 分析结果证实了 CeO2 结构中掺杂了金属。除了多孔形貌,FESEM 图像还显示了掺杂不同金属后引起的粒度变化。我们还测试了合成的 NP 在紫外光下对亚甲蓝(MB)染料的光催化功能,结果表明 Tl-CeO2 NP 具有优异的降解功能。我们通过 MTT 试验结果研究了合成的纯 NP 以及 Tl、Pb 和 Bi-CeO2 NP 对乳腺癌细胞(MDA-MB-231)和乳腺正常细胞(MCF-10 A)的毒性。合成的 NPs 对 MCF-10 A 和 MDA-MB-231 细胞没有任何细胞毒性作用,这表明通过引入掺杂工艺生成的纳米粒子是无毒的。因此,我们建议将我们的产品应用于药物输送系统以及类似于染料光降解和消除污染的工业应用中。
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引用次数: 0
Synthesis, spectral, DFT and anticancer studies on bis(N-(3-methoxybenzyl)-N-(pyridin-3-ylmethyl)dithiocarbamato-S,S’)M(II) (M= Pd, Pt) 双(N-(3-甲氧基苄基)-N-(吡啶-3-基甲基)二硫代氨基甲酸-S,S')M(II) (M= Pd, Pt) 的合成、光谱、DFT 和抗癌研究
IF 3.2 4区 化学 Q2 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2024-09-03 DOI: 10.1016/j.jics.2024.101357

We reported synthesis of bis(N-(3-methoxybenzyl)-N-(pyridin-3-ylmethyl)dithiocarbamato-S,S’)M(II) (where M(II) = palladium(II) (1), platinum(II) (2)). Both the complexes were characterized by elemental analysis, FTIR, UV–visible, 1H and 13C NMR spectroscopy. Based on FTIR spectral studies, bidentate coordination of dithiocarbamate ligand was proposed for both complexes. UV–visible spectral data confirm the formation of square planar complexes. The structure properties, frontier molecular orbital (FMO), molecular electrostatic potential (MEP), chemical reactivities and Mulliken charges were investigated using density functional theory (DFT)/B3LYP methods with 6-31+G (d, p) basis sets and LanL2DZ for light atoms and heavy atoms, respectively. FMO and Mulliken charges recognize the chemical active sites of 1 and 2 responsible for its chemical activity. In vitro anticancer activity of complexes 1 and 2 were analyzed on MCF-7 by MTT assay method. Results show that platinum complex 2 has higher activity compared to these of palladium complex 1.

我们报告了双(N-(3-甲氧基苄基)-N-(吡啶-3-基甲基)二硫代氨基甲酸-S,S')M(II)(其中 M(II) = 钯(II) (1),铂(II) (2))的合成。这两种复合物都通过元素分析、傅立叶变换红外光谱、紫外-可见光谱、1H 和 13C NMR 光谱进行了表征。根据傅立叶变换红外光谱研究,这两种配合物都含有二硫代氨基甲酸配体的双齿配位。紫外-可见光谱数据证实了方形平面配合物的形成。利用密度泛函理论(DFT)/B3LYP 方法,分别用 6-31+G (d, p) 基集和 LanL2DZ 对轻质原子和重质原子进行了结构性质、前沿分子轨道(FMO)、分子静电位(MEP)、化学反应活性和 Mulliken 电荷的研究。FMO 和 Mulliken 电荷识别出了 1 和 2 的化学活性位点,这些位点负责其化学活性。采用 MTT 检测法分析了铂络合物 1 和 2 对 MCF-7 的体外抗癌活性。结果表明,与钯复合物 1 相比,铂复合物 2 具有更高的活性。
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引用次数: 0
Efficient photodegradation of methylene blue dye using cerium-doped titanium dioxide (Ce@TiO2) photocatalyst under visible light irradiation 在可见光照射下使用掺铈二氧化钛(Ce@TiO2)光催化剂高效光降解亚甲基蓝染料
IF 3.2 4区 化学 Q2 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2024-08-31 DOI: 10.1016/j.jics.2024.101356

Water pollution is one of the important threats nowadays, to meet the difficulties several studies are being processed. This work aims to improve water quality by breaking dye components from the waste effluents of textile industries. Methylene blue (MB) widely used textile colorant brings several health issues to all living categories aquatic and terrestrial, including humans. All new syntheses of Cerium-doped Titanium dioxide (Ce@TiO2) nanoparticles have been achieved and proven to be a super-efficient photocatalyst for the photodegradation of MB in wastewater samples. This photocatalyst was prepared using the sol-gel technique without any hazardous chemicals in moderate conditions. The formation of Ce@TiO2 is confirmed by different characterization using XRD, FTIR, SEM-EDS, and HR-TEM analysis. The photocatalytic efficiency of Ce@TiO2 photocatalyst is carried out with varying parameters such as pH, contact time, photocatalyst dose, and MB concentration. Ce@TiO2 is an effective photocatalyst for MB degradation from wastewater at optimized conditions with 92 % removal within 90 min of reaction time. The degradation kinetics follow a pseudo-first-order model, with a rate constant (K) of 0.027min−1, while achieving a remarkable total organic carbon elimination of over 90.0 %. Furthermore, the reusability test showcased the remarkable stability of Ce@TiO2 over four cycles, with only a minor decline (<8 %) observed in MB degradation efficiency.

水污染是当今的重要威胁之一,为了应对这一难题,目前正在进行多项研究。这项工作旨在通过分解纺织工业废水中的染料成分来改善水质。广泛使用的纺织着色剂亚甲基蓝(MB)给包括人类在内的所有水生和陆生生物带来了一些健康问题。新合成的掺铈二氧化钛(Ce@TiO2)纳米粒子已被证实是一种超高效光催化剂,可用于光降解废水样品中的甲基溴。这种光催化剂是利用溶胶-凝胶技术在温和条件下制备的,不含任何有害化学物质。利用 XRD、FTIR、SEM-EDS 和 HR-TEM 分析的不同表征证实了 Ce@TiO2 的形成。随着 pH 值、接触时间、光催化剂剂量和甲基溴浓度等参数的变化,Ce@TiO2 光催化剂的光催化效率也随之变化。在优化条件下,Ce@TiO2 是一种有效的光催化剂,可在 90 分钟的反应时间内去除废水中 92% 的甲基溴。降解动力学遵循伪一阶模型,速率常数(K)为 0.027min-1,有机碳总去除率超过 90.0%。此外,可重复使用性测试表明,Ce@TiO2 在四个周期内具有显著的稳定性,甲基溴降解效率仅略有下降(8%)。
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引用次数: 0
Rapid removal of methyl orange from aqueous media by modified Mg–Al layered double hydroxides 利用改性镁铝双层氢氧化物快速去除水介质中的甲基橙
IF 3.2 4区 化学 Q2 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2024-08-31 DOI: 10.1016/j.jics.2024.101355

The current work deals with the synthesis of polymer modified synthetic clay, composed of Mg–Al layered double hydroxides (LDHs) and using a non-toxic organic polymer polyethylene glycol-400 (PEG400). A series of polymer-composites of Mg–Al LDH (LDHP-400) are prepared by changing concentrations of PEG-400 from 4% to 20 %, to find out the maximum adsorption efficiency for the adsorption of an industrially important anionic azo dye, MO from aqueous. The results depicted that LDH-P400, with 16 % PEG-400 shown the removal efficiency of 99.49 % for 100 ppm solution of MO (20 min). Effect of different factors such as dose of adsorbate, temperature, contact time, and pH of the solution, etc. are systematically investigated using batch experiments and thermodynamics parameters as well as kinetic studies are also carried out for the quick and instantaneous removal of MO from aqueous media. Maximum adsorption capacity of 198 mg/g has been achieved at pH4.2 and at temperature 313K for 100 ppm (mg/l) of MO in aqueous media using 0.5 g/l of adsorbent dose. Desorption studies reveal that prepared LDHP-400 can be reused and recycle up to three successive cycles with achieving 88.23 % recovery of MO, which confirmed that prepared LDHP-400 can be reused effectively for laboratory or industrial wastewater which has MO concentrations up to 100 ppm.

目前的研究涉及聚合物改性合成粘土的合成,这种粘土由镁铝层状双氢氧化物(LDHs)组成,并使用无毒有机聚合物聚乙二醇-400(PEG400)。通过改变 PEG-400 的浓度(从 4% 到 20%),制备了一系列 Mg-Al LDH 聚合物复合材料(LDHP-400),以找出吸附水体中工业上重要的阴离子偶氮染料 MO 的最大吸附效率。结果表明,PEG-400 含量为 16% 的 LDH-P400 对 100 ppm 的 MO 溶液(20 分钟)的去除率为 99.49%。利用批量实验系统地研究了不同因素的影响,如吸附剂的剂量、温度、接触时间和溶液的 pH 值等,还进行了热力学参数和动力学研究,以快速、瞬时地去除水介质中的 MO。在 pH 值为 4.2、温度为 313K 的条件下,使用 0.5 克/升的吸附剂剂量,水介质中 100 ppm(毫克/升)的 MO 的最大吸附容量为 198 毫克/克。解吸研究表明,制备的 LDHP-400 可连续循环使用三次,MO 回收率达 88.23%。
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引用次数: 0
Asymmetric pseudocapacitive electrodes for high energy density supercapacitor in aqueous electrolyte 水基电解质中用于高能量密度超级电容器的不对称伪电容电极
IF 3.2 4区 化学 Q2 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2024-08-31 DOI: 10.1016/j.jics.2024.101354

An Asymmetric pseudocapacitor electrodes can achieve higher energy density than carbon-based materials. Ruthenium oxide is the most effective pseudocapacitor material, but it's very expensive and toxic. The use of cerium oxide (CeO2), which is abundant with good redox properties could be a sustainable alternative for positive electrode. However, CeO2's low electronic conductivity limits its performance. To overcome this an asymmetric supercapacitor cell (ASC) was constructed using CeO2 as the positive electrode and instead of carbon-based materials, MXene (Ti3C2Tx) was used as the negative electrode. MXene can deliver better capacitance due to the controllable layer spacing and excellent electronic conduction which can improve the overall conductivity of the ASC. CeO2//MXene asymmetric cell achieved 122.27 Fg-1 capacitance with 55.02 Wh Kg−1 energy density, and retained 99.36 % initial capacitance after 10,000 cycles at 20 Ag-1.

与碳基材料相比,不对称伪电容器电极可以获得更高的能量密度。氧化钌是最有效的伪电容器材料,但它非常昂贵且有毒。氧化铈(CeO2)资源丰富,具有良好的氧化还原特性,可以作为正极的可持续替代材料。然而,CeO2 的低电子传导性限制了它的性能。为了克服这一问题,我们用 CeO2 作为正极,用 MXene(Ti3C2Tx)代替碳基材料作为负极,构建了不对称超级电容器电池(ASC)。由于 MXene 具有可控的层间距和出色的电子传导性,因此可以提供更好的电容,从而提高 ASC 的整体导电性。CeO2//MXene 不对称电池的电容达到 122.27 Fg-1,能量密度为 55.02 Wh Kg-1,在 20 Ag-1 条件下循环 10,000 次后,初始电容保持率为 99.36%。
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引用次数: 0
Biosorptive removal of toxic nitrate ion from wastewater using Albizia lebbeck seed pods: Isotherm and equilibrium studies 利用Albizia lebbeck豆荚生物吸附去除废水中的有毒硝酸盐离子:等温线和平衡研究
IF 3.2 4区 化学 Q2 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2024-08-31 DOI: 10.1016/j.jics.2024.101353

A major environmental issue that contaminates drinking water and endangers human health is nitrate pollution. In this study, goethite, citric acid, tartaric acid was employed to modify Albizia lebbeck seed pod for the biosorption of nitrate ion. The developed unmodified Albizia lebbeck (UALB), citric acid modified Albizia lebbeck (CALB), tartaric acid modified Albizia lebbeck (TALB), and goethite acid modified Albizia lebbeck (GALB) were characterized using scanning electron microscopy (SEM), fourier transform infrared spectroscopy (FTIR), and point of zero charge (pHpzc) to determine the structural morphology, functional group, and adsorbent surface charge. The adsorption nitrate ion onto the biosorbents was found to be dependent on the operating parameters. The findings revealed that the maximum percentage removal of nitrate ion was 80.8 % at pH 7 for UALB, 80.3 % at pH = 4.0 for CALB, 70.30 % at pH = 3.0 for TALB and 76 % at pH 7 for GALB. The adsorption experimental data for nitrate ion adsorption onto ULAB, CALB, TALB, and GALB were best described by the Langmuir isotherm model. The UALB exhibited the highest Langmuir monolayer adsorption capacities with a value of 344.827 mg/g. Therefore, the unmodified form of Albizia lebbeck (UALB) which is economical, and sustainable provides an efficient alternative method for nitrate removal in aqueous environment.

硝酸盐污染是污染饮用水和危害人类健康的一个主要环境问题。在这项研究中,采用了鹅卵石、柠檬酸和酒石酸来改性白花莱贝克豆荚,以实现对硝酸根离子的生物吸附。利用扫描电子显微镜(SEM)、傅立叶变换红外光谱(FTIR)和零电荷点(pHpzc)对所开发的未改性白花蛇舌草(UALB)、柠檬酸改性白花蛇舌草(CALB)、酒石酸改性白花蛇舌草(TALB)和鹅卵石酸改性白花蛇舌草(GALB)进行了表征,以确定其结构形态、官能团和吸附剂表面电荷。研究发现,生物吸附剂对硝酸根离子的吸附取决于操作参数。研究结果表明,UALB 在 pH 值为 7 时对硝酸根离子的最大去除率为 80.8%,CALB 在 pH 值为 4.0 时为 80.3%,TALB 在 pH 值为 3.0 时为 70.30%,GALB 在 pH 值为 7 时为 76%。ULAB、CALB、TALB 和 GALB 对硝酸根离子的吸附实验数据用 Langmuir 等温线模型进行了最佳描述。UALB 表现出最高的 Langmuir 单层吸附容量,其值为 344.827 mg/g。因此,未经改性的白兰地(UALB)既经济又可持续,是水环境中去除硝酸盐的有效替代方法。
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引用次数: 0
Thermoelectric properties of polycrystalline pristine and Pb-doped SnS materials using a conventional hydrothermal method 采用传统水热法研究原始多晶和掺杂铅的 SnS 材料的热电特性
IF 3.2 4区 化学 Q2 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2024-08-30 DOI: 10.1016/j.jics.2024.101351
Tin Sulfide (SnS) has recently garnered significant attention due to its impressive Seebeck coefficient and low thermal conductivity. However, its electrical performance is notably poor, necessitating appropriate doping for its enhancement. To address this, we employed the conventional hydrothermal method to synthesize polycrystals of pristine and lead (Pb)-doped SnS samples to observe the impact on thermoelectric parameters. Utilizing FESEM, we obtained sheet sizes on the nanometer scale and observed irregular sheet-type morphology. HRTEM analysis confirmed the polycrystalline nature of the synthesized samples. Thermal stability assessment through thermogravimetric analysis (TGA) was conducted on all samples up to a temperature of 600 °C. The hydrothermal method resulted in nanostructuring that effectively suppressed the thermal conduction of low-frequency phonons, with increased phonon scattering attributed to the small grain size of particles. For pristine SnS nanoparticles, we determined the lowest total thermal conductivity (κT) to be 0.18 W (m-K)−1, and the highest Seebeck coefficient reached 412.71 μVK−1 at 620 K. In the case of the SnS–Pb(3 wt%) doped sample, there was a slight reduction in the total thermal conductivity (κT) compared to the pristine SnS sample. The pristine SnS sample exhibited the highest electrical conductivity (σ) of 0.21 S/cm at 620 K. In contrast, the SnS–Pb(3 wt%) doped sample demonstrated a twofold increase in electrical conductivity, measuring 0.38 S/cm at 620 K. This enhancement can be attributed to the increased carrier concentration resulting from the Pb(3 wt%) doping of SnS.
硫化锡(SnS)因其出色的塞贝克系数和较低的热导率而在最近引起了广泛关注。然而,它的电气性能明显较差,因此需要适当掺杂以提高其性能。为此,我们采用传统的水热法合成了原始和掺铅 (Pb) SnS 样品的多晶体,以观察其对热电参数的影响。利用 FESEM,我们获得了纳米级的薄片尺寸,并观察到了不规则的片状形态。HRTEM 分析证实了合成样品的多晶性质。通过热重分析(TGA)对所有样品进行了热稳定性评估,最高温度为 600 ℃。水热法产生的纳米结构有效地抑制了低频声子的热传导,声子散射的增加归因于颗粒的粒度较小。对于原始 SnS 纳米颗粒,我们测定的最低总热导率(κT)为 0.18 W (m-K)-1,最高塞贝克系数在 620 K 时达到 412.71 μVK-1。相比之下,掺杂了 SnS-Pb(3 wt%) 的样品的导电率提高了两倍,在 620 K 时达到 0.38 S/cm。
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引用次数: 0
期刊
Journal of the Indian Chemical Society
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