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Structural and Optoelectronic Properties of Zinc Sulfide Thin Films Synthesized by Co-Precipitation Method 共沉淀法合成硫化锌薄膜的结构与光电性能
IF 0.5 Q4 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2019-12-01 DOI: 10.2478/achi-2019-0018
V. Choudapur, S. B. Kapatkar, A. Raju
Abstract Wide bandgap Zinc Sulfide nanocrystals are prepared by a simple co-precipitation method at different precursor concentrations. The influence of sulphur concentration in Zinc sulfide on morphological, optical and electric properties is found to be significant. The Zinc Sulfide nanomaterial was prepared using low-cost starting materials and deionised water as the solvent. As synthesized Zinc Sulfide nanocrystals were analyzed using X-ray diffraction (XRD), Energy Dispersive Spectroscopy (EDS) analysis, UV-Visible Spectrophotometry, Photoluminescence (PL), Scanning electron Microscopy (SEM), Ellipsometry techniques and electric conductivity measurements. XRD patterns revealed that ZnS nanocrystals are polycrystalline, cubic phase with (111) preferred orientation. The obtained crystallites have sizes in the range of 5 to 11 nm. EDS pattern confirms the purity of the films. From optical absorption measurements, it is clear that the direct energy gap decreases from 5.2 to 4.4eV with the increase in sulphur concentration in ZnS and exhibit large quantum confinement effect. Ellipsometry was used to determine the optical constants and film thickness. The films deposited on ITO – coated glass was used to record the IV Characteristics of the films by two probe method. The wide-bandgap, conducting materials have applications in optoelectronic devices such as high-frequency UV detectors and thin-film solar cells.
摘要在不同前驱体浓度下,采用简单共沉淀法制备了宽禁带硫化锌纳米晶体。硫化物中硫的浓度对锌的形态、光学和电学性质的影响是显著的。以低成本原料和去离子水为溶剂制备了硫化锌纳米材料。采用x射线衍射(XRD)、能谱分析(EDS)、紫外可见分光光度法、光致发光(PL)、扫描电镜(SEM)、椭偏技术和电导率测量等方法对合成的硫化锌纳米晶体进行了分析。XRD分析表明,ZnS纳米晶为多晶、立方相、(111)择优取向。所得晶体尺寸在5 ~ 11nm之间。能谱图证实了薄膜的纯度。光学吸收测量表明,随着ZnS中硫浓度的增加,直接能隙从5.2 ev减小到4.4eV,并表现出较大的量子约束效应。采用椭偏法测定了光学常数和膜厚。用双探针法记录了沉积在ITO涂层玻璃上的膜的IV特性。这种宽带隙导电材料在光电器件中有广泛的应用,如高频紫外探测器和薄膜太阳能电池。
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引用次数: 11
Treatment of Real Textile Wastewater Using Electron Beam Irradiation 电子束辐照处理纺织废水的研究
IF 0.5 Q4 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2019-12-01 DOI: 10.2478/achi-2019-0019
N. N. Duy, Dang Van Phu, Nguyen Thi Kim Lan, N. T. Duoc, N. Q. Hien, Bui Nghia Hiep, B. N. Han, B. Ha
Abstract Textile wastewater is known to have a large number of hazardous pollutants, intense color and high chemical oxygen demand (COD) concentration. The electron beam method is considered useful in treatment textile wastewater through chemical oxidation process. In this study, three real textile wastewaters (Sample 1: Reactive Black 5, Reactive Red 10, and Reactive Orange 13; Sample 2: Reactive Red 10 and Yellow GR; Sample 3: Reactive Black 5 and Turquoise Blue HF–G) from textile dyeing company in Ho Chi Minh city were treated by electron beam method. The effect of absorbed doses and hydrogen peroxide (H2O2) at different concentrations on the change of pH, removal capacity, COD and five day’s biological oxygen demand (BOD5) were investigated. The results indicated that color, COD, BOD5 and pH decreased with increasing absorbed dose. A sufficient amount of H2O2 in the radiation process could accelerate the color removal process. In the same condition, a color removal efficiency of ~90% was obtained with EB/H2O2, in contrast with color loss by using EB alone (~71%). These results highlighted the potential of EB radiation technology for treatment of textile dyeing wastewater.
摘要纺织废水含有大量有害污染物,颜色强烈,化学需氧量(COD)浓度高。电子束法是一种有效的化学氧化法处理纺织废水的方法。在本研究中,三个真实的纺织废水(样品1:活性黑色5,活性红色10和活性橙色13;样品2:活性红10和活性黄GR;用电子束法对来自胡志明市纺织印染公司的样品3:活性黑5和绿松石蓝HF-G进行了处理。研究了吸收剂量和不同浓度过氧化氢(H2O2)对pH、去除率、COD和5 d生物需氧量(BOD5)变化的影响。结果表明,随着吸收剂量的增加,其颜色、COD、BOD5和pH均呈下降趋势。在辐照过程中加入足量的H2O2可以加速脱色过程。在相同条件下,EB/H2O2的去色率为~90%,而单独使用EB的去色率为~71%。这些结果突出了EB辐射技术处理纺织印染废水的潜力。
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引用次数: 4
DFT Investigation of Structural and Electronic Properties of Modified PZT 改性PZT结构及电子性能的DFT研究
IF 0.5 Q4 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2019-06-01 DOI: 10.2478/achi-2019-0002
R. K. Hussein, I. Bashter, M. El-Okr, M. Ibrahim
Abstract Density of states and geometrical structures of modified Lead zirconate titanate are investigated using density functional theory within local density approximation. The electronic properties and bond length variation have been studied in terms of electronic structure and bonding mechanism principles respectively. Hybridization between Ti 3d - O 2p states and ferroelectric distortion have been addressed as a theoretical approach, to rule the improvement of ferroelectric properties of Lead zirconate titanate. The analysis of Ga, Tl modified Lead zirconate titanate were found to diminish the hybridization between Ti 3d - O 2p states, the relaxed behavior lead to the reversal of the known ferroelectric distortion. Y, Ho, Yb and Lu modified Lead zirconate titanate compounds have a tendency to intense the ferroelectric stability, its exhibit higher hybridization between Ti 3d - O 2p states than pure Lead zirconate titanate, also the arrangement of the ions distortions is strongly the same as the more favoured ferroelectric states of Lead zirconate titanate.
摘要利用局部密度近似下的密度泛函理论研究了改性锆钛酸铅的态密度和几何结构。分别从电子结构和成键机理的角度研究了其电子性质和键长变化。本文从理论上研究了钛酸锆铅的三维o2p杂化和铁电畸变,以指导钛酸锆铅铁电性能的改善。分析发现,Ga、Tl修饰的锆钛酸铅减少了Ti 3d - o2p态之间的杂化,弛豫行为导致已知铁电畸变的逆转。Y、Ho、Yb和Lu改性的锆钛酸铅化合物具有增强铁电稳定性的趋势,与纯锆钛酸铅相比,其表现出更高的Ti 3d - o2p杂化态,且离子畸变排列与锆钛酸铅更有利的铁电态相同。
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引用次数: 2
Surface Modification of Poly(Ethylene Terephthalate) in Air Plasma 聚对苯二甲酸乙酯在空气等离子体中的表面改性
IF 0.5 Q4 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2019-06-01 DOI: 10.2478/achi-2019-0010
M. Drobotă, A. Trandabăț, M. Pîslaru
Abstract This paper reports the modification of a polyester film surface in air plasma at room temperature. In order to evaluate the efficiency of the plasma treatment, the modified surface of the PET films was characterized by contact angle and ATR-FTIR spectroscopy.
摘要本文报道了室温空气等离子体对聚酯薄膜表面的改性。为了评价等离子体处理的效果,利用接触角和ATR-FTIR光谱对改性后的PET膜表面进行了表征。
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引用次数: 2
Diethanolamine-Induced Hepatic Steatosis in Mice and Its Amelioration by Curcumin 二乙醇胺致小鼠肝脏脂肪变性及姜黄素的改善作用
IF 0.5 Q4 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2019-06-01 DOI: 10.2478/achi-2019-0009
Hetal Doctor, Sanman Samova, R. Verma
Abstract Extensive use of chemicals in personal care products has led to many health issues. Diethanolamine is one of such harmful chemicals containing two highly functional groups alcohol and amine that requires toxicological evaluation and its mitigation. Swiss strain albino mice were used and divided into different control and treated groups. Different doses of DEA (110, 165 and 330 mg/kg body weight/day) were orally administered for 30 days. Biochemical and histopathological assessments were performed at the end of the treatment. Results collectively revealed body weight loss as well as significant increase in absolute and relative liver weight in DEA-treated groups. Biochemical analysis revealed that DEA treatment further promotes significant (P<0.05), dose-dependent increase in lipid and cholesterol contents and also cause decrease in protein and glycogen content. Histopathological assessment confirms vacuole formation due to accumulation of lipid within the liver tissue. Administration of curcumin (10, 20 and 30 mg/kg body weight/day) along with high dose of DEA (330 mg/kg body weight/day) showed improved values of lipid, cholesterol, protein and glycogen contents. It also helped retaining normal histological structure of liver. Observations in all groups and results indicate DEA-treatment causes hepatic steatosis and treatment of curcumin attenuated effect of DEA that is due to its potential antioxidant properties.
个人护理产品中化学品的广泛使用导致了许多健康问题。二乙醇胺就是这样一种有害化学物质,它含有两个高官能团醇和胺,需要进行毒理学评估和缓解。采用瑞士白化病小鼠,分为不同的对照组和治疗组。不同剂量的DEA(110、165和330 mg/kg体重/天)口服30天。在治疗结束时进行生化和组织病理学评估。结果显示,dea治疗组体重减轻,肝脏绝对重量和相对重量显著增加。生化分析显示,DEA处理进一步促进大鼠脂质和胆固醇含量呈剂量依赖性显著升高(P<0.05),并导致蛋白质和糖原含量降低。组织病理学检查证实了由于肝组织内脂质积累而形成的空泡。姜黄素(10、20和30 mg/kg体重/天)和高剂量DEA (330 mg/kg体重/天)可改善血脂、胆固醇、蛋白质和糖原含量。它还有助于保持肝脏的正常组织结构。所有组的观察和结果表明,DEA治疗导致肝脂肪变性,姜黄素治疗减弱了DEA的作用,这是由于其潜在的抗氧化特性。
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引用次数: 0
Application of the Shrinking-Core Models for Determination of Dissolution Kinetics of Mn and Zn from Spent Zinc–Carbon Battery Powder in Organic Acid Solution 缩核模型在废锌碳电池粉末中锰、锌在有机酸溶液中溶解动力学测定中的应用
IF 0.5 Q4 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2019-06-01 DOI: 10.2478/achi-2019-0008
T. Agacayak, H. A. Taner
Abstract In this study, dissolution kinetics of manganese and zinc from spent zinc–carbon batteries in acetic acid solution was investigated. To determine the kinetics of dissolution of manganese and zinc, shrinking core model was applied to dissolution recoveries obtained at different temperatures. As a result of kinetic studies, it was determined that manganese and zinc were dissolved in acetic acid solution by diffusion from product layer and then activation energies (Ea) were calculated.
研究了废锌碳电池中锰和锌在乙酸溶液中的溶解动力学。为了确定锰和锌的溶解动力学,采用收缩核模型对不同温度下的溶解回收率进行了计算。通过动力学研究,确定了锰和锌是由产物层扩散溶解在乙酸溶液中的,并计算了活化能。
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引用次数: 3
Onsome New Neighbourhood Degree Based Indices 基于邻域度的一些新指标
IF 0.5 Q4 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2019-06-01 DOI: 10.2478/achi-2019-0003
S. Mondal, Nilanjan De, A. Pal
Abstract In this paper, four novel topological indices named as neighbourhood version of forgotten topological index (FN), modified neighbourhood version of Forgotten topological index (FN*), neighbourhood version of second Zagreb index (M2*) and neighbourhood version of hyper Zagreb index (HMN) are introduced. Here the relatively study depends on the structure-property regression analysis is made to test and compute the chemical applicability of these indices for the prediction of physicochemical properties of octane isomers. Also it is shown that these newly presented indices have well degeneracy property in comparison with other degree based topological indices. Some mathematical properties of these indices are also discussed here.
摘要本文介绍了遗忘拓扑指数邻域版(FN)、遗忘拓扑指数修正邻域版(FN*)、第二萨格勒布指数邻域版(M2*)和超萨格勒布指数邻域版(HMN)四个新型拓扑指数。本文通过结构性质回归分析来检验和计算这些指标在预测辛烷异构体理化性质方面的化学适用性。与其他基于度的拓扑指标相比,这些指标具有良好的简并性。本文还讨论了这些指标的一些数学性质。
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引用次数: 53
Zagreb Connection Indices of Two Dendrimer Nanostars 两种树状纳米星的Zagreb连接指数
IF 0.5 Q4 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2019-06-01 DOI: 10.2478/achi-2019-0001
N. Fatima, A. A. Bhatti, Akbar Ali, Wei Gao
Abstract It is well known fact that several physicochemical properties of chemical compounds are closely related to their molecular structure. Mathematical chemistry provides a method to predict the aforementioned properties of compounds using topological indices. The Zagreb indices are among the most studied topological indices. Recently, three modified versions of the Zagreb indices were proposed independently in [Ali, A.; Trinajstić, N. A novel/old modification of the first Zagreb index, arXiv:1705.10430 [math.CO] 2017; Mol. Inform. 2018, 37, 1800008] and [Naji, A. M.; Soner, N. D.; Gutman, I. On leap Zagreb indices of graphs, Commun. Comb. Optim. 2017, 2, 99–117], which were named as the Zagreb connection indices and the leap Zagreb indices, respectively. In this paper, we check the chemical applicability of the newly considered Zagreb connection indices on the set of octane isomers and establish general expressions for calculating these indices of two well-known dendrimer nanostars.
摘要化合物的一些理化性质与其分子结构密切相关,这是众所周知的事实。数学化学提供了一种利用拓扑指数预测化合物上述性质的方法。萨格勒布指数是研究最多的拓扑指数之一。最近,在[Ali, A.;崔纳斯提克,N.第一个萨格勒布指数的新/旧修正[j] .中文信息学报,14:1705.10430。有限公司)2017;[j] .科学通报,2018,33(2):1 - 8。森纳,北达科他州;图的跳跃萨格勒布指数,公共。梳子。Optim. 2017, 2, 99-117],分别命名为萨格勒布连接指数和飞跃萨格勒布指数。在本文中,我们检验了新考虑的萨格勒布连接指数在辛烷异构体集合上的化学适用性,并建立了计算两种已知树状纳米星的这些指数的一般表达式。
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引用次数: 20
Some New Heterocyclisations Based on N-(2,2-dichloro-1-isothiocyanatoethyl)benzamide Derivatives 基于N-(2,2-二氯-1-异硫氰酸乙酯)苯酰胺衍生物的一些新的杂环化合物
IF 0.5 Q4 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2019-06-01 DOI: 10.2478/achi-2019-0005
Ihor O. Pokotylo, P. Zadorozhnii, V. Kiselev, O. V. Okhtina, A. V. Kharchenko
Abstract Based on the readily available N-(2,2-dichloro-1-(2-(4-methylbenzoyl)-hydrazine-1-carbothioamido)ethyl)benzamide, the corresponding N-(2,2-dichloro-1-((5-(p-tolyl)-1,3,4-oxadiazol-2-yl)amino)ethyl)benzamide and 5-(p-tolyl)-1,3,4-thiadiazol-2-amine were obtained. The products were received in acceptable yields and were isolated from the reaction mixture without any particular difficulty. The structure of the compounds obtained was confirmed by 1H, 13C NMR spectroscopy and mass spectrometry data.
摘要以现有的N-(2,2-二氯-1-(2-(4-甲基苯甲酰)-肼-1-碳硫氨基)乙基)苯酰胺为基础,合成了相应的N-(2,2-二氯-1-(5-(对苯基)-1,3,4-恶二唑-2-基)氨基)乙基)苯酰胺和5-(对苯基)-1,3,4-噻二唑-2-胺。产品以可接受的收率接收,并从反应混合物中分离出来,没有任何特别的困难。所得化合物的结构经1H、13C NMR和质谱数据证实。
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引用次数: 0
Preparation and Characterization of Spion-CDs as a Multifunctional Fluorescence/Magnetic Resonance Nanoparticle 多功能荧光/磁共振纳米粒子的制备与表征
IF 0.5 Q4 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2019-06-01 DOI: 10.2478/achi-2019-0007
M. Asgari, Hasan Motaghi, H. Khanahmad, M. Mehrgardi, Amin Farzadniya, Parvaneh Shokrania
Abstract A multifunctional nanoparticle, Super Paramagnetic Iron Oxide Nanoparticle-Carbon Dots (SPION-CDs), for fluorescence and magnetic resonance imaging is introduced. This nanoparticle possesses the magnetic properties of super-paramagnetic iron oxide (SPION) core as well as the fluorescence characteristics of carbon dots (CDs) coated in mesoporous structure. The SPION-CDs were synthesized using a high temperature facile single-pot hydrothermal method. The products were characterized by transmission electron microscopy (TEM), dynamic light scattering (DLS), X-ray diffraction (XRD), UV/vis absorption, vibrating sample magnetometer (VSM). The cytotoxic effect of SPION-CDs on OVCAR-3 cells was also evaluated. The synthesized nanoparticle possesses optimal size, low toxicity and excellent magnetic properties, including super-paramagnetic behavior (Ms = 42 emu g−1). Moreover, in the viewpoint of optical properties, the quantum yield of ~2.4% was obtained and the nanoparticle shows good fluorescence stability for cell-labeling studies. This multifunctional nanoparticle with appropriate characterization is a promising candidate for multimodal fluorescence/magnetic resonance imaging platform.
摘要介绍了一种用于荧光和磁共振成像的多功能纳米粒子——超顺磁性氧化铁纳米颗粒-碳点(SPION-CDs)。该纳米粒子具有超顺磁性氧化铁(SPION)核的磁性和包被介孔结构的碳点(CDs)的荧光特性。采用高温单锅水热法合成了SPION-CDs。采用透射电子显微镜(TEM)、动态光散射(DLS)、x射线衍射(XRD)、紫外/可见吸收、振动样品磁强计(VSM)对产物进行了表征。我们还评估了SPION-CDs对OVCAR-3细胞的细胞毒性作用。合成的纳米颗粒具有最佳尺寸、低毒性和优异的磁性,包括超顺磁性(Ms = 42 emu g−1)。此外,在光学性质方面,获得了~2.4%的量子产率,纳米颗粒具有良好的荧光稳定性,可用于细胞标记研究。这种具有适当特性的多功能纳米颗粒是多模态荧光/磁共振成像平台的有希望的候选材料。
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引用次数: 2
期刊
Acta Chemica Iasi
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