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Adsorption and Photocatalytic Removal of Arsenic from Water by a Porous and Magnetic Nanocomposite: Ag/TiO2/Fe3O4@GO Ag/TiO2/Fe3O4@GO多孔磁性纳米复合材料对水中砷的吸附及光催化去除
Pub Date : 2020-06-01 DOI: 10.33945/sami/ajca.2020.4.3
M. Miranzadeh, F. Afshari, Behnoosh Khataei, M. Kassaee
As (III) regularly requires oxidation to As (V), before it can be removed from water. Here, we reported photocatalytic removal of As (III) as well as adsorption of As (III) and As (V) using a novel, porous magnetic Ag/TiO2/Fe3O4@GO nanocomposite which was characterized via FT-IR, XRD, SEM, and TEM. A mathematical model (the central composite design) was used to estimate the relationship between the observed adsorption and our set of variables including initial concentration of arsenic ions, adsorbent dosage, pH, and the contact time. An optimum adsorption capacity of about 91% was observed for As (III) using 20 mg adsorbent with 24 ppm initial concentration of As (III), at pH = 5, within 90 min, and room temperature. Likewise, an optimum adsorption capacity of about 87% was observed for As (V) using 11 mg adsorbent with 17 ppm initial concentration of As (V), at pH = 3, within 30 min, and room temperature. The electrostatic factors between surface charge of nanocomposite and arsenic species were used to explain adsorption behavior of As (III) and As (V) at different conditions. The Langmuir isotherm equations best interpreted the nature of adsorption of As (III) and A (V). It was found during phocatalytic process maximum R% was about 63% for As (III) using 40 mg photocatalyst.
As (III)通常需要氧化成As (V),才能从水中除去。本文报道了一种新型多孔磁性Ag/TiO2/Fe3O4@GO纳米复合材料对As (III)的光催化去除以及As (III)和As (V)的吸附,并通过FT-IR、XRD、SEM和TEM进行了表征。使用数学模型(中心复合设计)来估计观察到的吸附与我们的一组变量之间的关系,这些变量包括砷离子的初始浓度、吸附剂剂量、pH和接触时间。在pH = 5、室温条件下,当吸附剂浓度为20 mg、初始浓度为24 ppm、吸附时间为90 min时,对As (III)的最佳吸附量约为91%。同样,当初始As (V)浓度为17 ppm、pH = 3、30 min、室温条件下,吸附剂浓度为11 mg时,对As (V)的最佳吸附量约为87%。利用纳米复合材料表面电荷与砷之间的静电因子来解释不同条件下As (III)和As (V)的吸附行为。Langmuir等温线方程很好地解释了As (III)和A (V)的吸附性质。在40 mg光催化剂的光催化过程中,As (III)的最大R%约为63%。
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引用次数: 5
Synthesis, Characterization and Antibacterial Activity Studies of Some Transition Metal Chelates of Mn(II), Ni(II) and Cu(II) with Schiff Base Derived from Diacetylmonoxime with O-phenylenediamine 二乙酰一亚胺-邻苯二胺席夫碱Mn(II)、Ni(II)和Cu(II)过渡金属螯合物的合成、表征及抗菌活性研究
Pub Date : 2020-06-01 DOI: 10.33945/SAMI/AJCA.2020.4.13
A. Hamil, K. M. Khalifa, Arabya A. A. Almutaleb, Mariam Qasim Nouradean
In this study, the transition metal chelates of Mn(II), Ni(II) and Cu(II) with Schiff base were synthesized and characterized. The elemental analysis data showed that, the isolated chelates are in 1:1 [M:L] ratio. The molar conductance values revealed that the chelates are none electrolyte in nature. The results of magnetic moment measurements demonstrated that, the chelates of Mn(II) and Cu(II) have unpaired electrons and chelates of Ni(II) is diamagnetic. The infrared spectral data displayed the main coordination sites of (2E, 3E)-3-((2-aminophenyl)imino)butan-2-one oxime towards Mn(II), Ni(II) and Cu(II) ions. The electronic spectrum results of the Schiff base ligand and its chelates suggest that the Mn(II) and Cu(II) chelates have octahedral structure and Ni(II) chelate is square planar.
本文合成了具有席夫碱的Mn(II)、Ni(II)和Cu(II)过渡金属螯合物,并对其进行了表征。元素分析数据表明,分离得到的螯合物[M:L]的比例为1:1。摩尔电导值表明螯合物本质上不是电解质。磁矩测量结果表明,Mn(II)和Cu(II)的螯合物具有不成对电子,Ni(II)的螯合物具有抗磁性。红外光谱数据显示了(2E, 3E)-3-((2-氨基苯基)亚氨基)丁醇-2-一肟对Mn(II)、Ni(II)和Cu(II)离子的主要配位。席夫碱配体及其螯合物的电子能谱结果表明,Mn(II)和Cu(II)螯合物为八面体结构,Ni(II)螯合物为方平面结构。
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引用次数: 8
Mitigation of Cu(II) from Aqueous Solution by Using Sandal Santalum Album Distillation Biomass 檀香相册蒸馏生物质对水溶液中Cu(II)的去除
Pub Date : 2020-06-01 DOI: 10.33945/sami/ajca.2020.4.9
Q. Hassan, Adil Munir, Asad Bashir, F. Ali, Rana Muhammad Shahid
In this study, mitigation of Cu(II) from aqueous solutions was evaluated using the sandal Santalum Album as biosorbent. The removal capacity of the Cu(II) was studied in batch experiments including such as initial metal concentration (25-400 mg/L), biosorbent dose (0.05-0.2 g), effects of contact time (0-1440 min), kinetics and pre-treatment of the biosorbent. The maximum removal of Cu(II) was obtained at the optimum pH of 5. The maximum equilibrium uptake for Cu(II) was  Ba(OH)2-SA(248.8 mg/g-1) at 400 ppm. Kinetics studies explained that, mitigation of the Cu(II) was very fast from 0 to 120 min and achieved equilibrium at 240 min. The equilibrium was well explained by Frendlich isotherm. Kinetics was well fitted to pseudo second order equation with high R2 values.
在本研究中,使用檀香檀香相册作为生物吸附剂,评估了水溶液中Cu(II)的缓蚀性。通过初始金属浓度(25 ~ 400 mg/L)、生物吸附剂剂量(0.05 ~ 0.2 g)、接触时间(0 ~ 1440 min)、动力学和生物吸附剂预处理对Cu(II)的去除能力进行了批量实验研究。最适pH值为5时,Cu(II)的去除率最高。400 ppm时Cu(II)的最大平衡吸收量为Ba(OH)2-SA(248.8 mg/g-1)。动力学研究表明,从0 ~ 120 min, Cu(II)的缓释速度非常快,并在240 min达到平衡,这一平衡可以用Frendlich等温线很好地解释。动力学符合拟二阶方程,R2值较高。
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引用次数: 1
Electronics Structure and Optical Properties of Ag2BiO3, (Ag2)0.88Fe0.12BiO3: A First Principle Approach Ag2BiO3, (Ag2)0.88Fe0.12BiO3的电子结构和光学性质:第一性原理方法
Pub Date : 2020-06-01 DOI: 10.33945/SAMI/AJCA.2020.4.15
Unesco Chakma, A. Kumer, Kamal Bikash Chakma, Md. Tawhidul Islam, Debashis Howlader
Electronic band structures, the total density of state, partial density of state and optical properties were investigated using first principle method for Ag2BiO3 via Generalized Gradient Approximation (GGA) based on the Perdew–Burke–Ernzerhof (PBE0). The band gap was found to be 0.490 eV which is supported for good semiconductor. The density of state and partial density of state were simulated for evaluating the nature of 5s, 4d for Ag, 6s, 4f, 5d, 6p for Bi and 2s, 2p for oxygen atom for Ag2BiO3 orbital travelling from the maximum valance band to minimum conduction band to explain the transition of electron due to hybridization. The optical properties including, absorption, reflection, refractive index, conductivity, dielectric function and loss function were calculated which can account for the superior absorption of the visible light. The key point of this research study was to determine the activity on electronics structure and optical properties for Fe doped by 12%. Regarding the band gap and optical properties, Ag2Bi0.88Fe0.12O3 can give more conductivity compared with that than of the Ag2BiO3,showing as a superconductor.
利用基于PBE0的广义梯度近似(GGA)第一性原理方法研究了Ag2BiO3的电子能带结构、态总密度、态偏密度和光学性质。发现带隙为0.490 eV,支持良好的半导体。通过模拟态密度和偏态密度,评价了Ag的5s、4d、Bi的6s、4f、5d、6p和Ag2BiO3轨道从最大价带向最小导带移动的氧原子的2s、2p的性质,解释了杂化引起的电子跃迁。计算了吸收、反射、折射率、电导率、介电函数和损耗函数等光学性质,说明了该材料对可见光的良好吸收。本研究的重点是确定掺铁12%对电子结构和光学性质的活性。在带隙和光性能方面,ag2bi0.88 fe0.120 o3比ag2bi3具有更高的导电性,表现为超导体。
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引用次数: 11
Utilization of Sustainable Energies for Purification of Water 利用可持续能源净化水
Pub Date : 2020-06-01 DOI: 10.33945/SAMI/AJCA.2020.4.11
M. Sajjadnejad, Seyed Mohammad Haghshenas, Vahid Tavakoli Targhi, H. Zahmatkesh, M. Naeimi
Water and energy are the most important topics on the environment and sustainable energy development agenda. The social and economic health of the modern world depends on sustainable supply of both energy and water. Many areas worldwide suffering from fresh water shortage are becoming increasingly dependent on purification as a highly reliable and non-conventional source of fresh water. Therefore, purification market has greatly expanded in recent decades and expected to continue in the coming years. The integration of renewable energy resources in purification and water purification has become increasingly attractive. This is justified by the fact that areas of fresh water shortages have plenty of solar energy and these technologies can be used due to their low operating and maintenance costs. This review paper discusses the systems that can be used to harness renewable energy sources including, solar collectors, solar ponds, photovoltaics, wind energy and geothermal energy and finally a discussion and conclusion about some distinguished features of each process. Merging of these renewable energy sources with conventional sources has led to optimize the performance of purification plant, less maintenance requirement and reduction in overall cost. It was found that, to choose the best renewable energy source for a purification plant in a particular area, important determinative factors should be considered such as water salinity, area remoteness, plant size, technical infrastructure of the plant, capacity factor, energy consumption and capital cost of the equipment.
水和能源是环境和可持续能源发展议程上最重要的议题。现代世界的社会和经济健康取决于能源和水的可持续供应。世界上许多遭受淡水短缺的地区越来越依赖净化作为一种高度可靠和非常规的淡水来源。因此,净化市场在最近几十年大大扩大,预计在未来几年将继续。可再生能源在净化和水净化方面的整合越来越具有吸引力。这是合理的,因为淡水短缺的地区有大量的太阳能,这些技术可以使用,因为它们的运行和维护成本低。本文综述了可再生能源利用的系统,包括太阳能集热器、太阳能池、光伏、风能和地热能,并对每个系统的特点进行了讨论和总结。这些可再生能源与传统能源的结合优化了净化装置的性能,减少了维护需求,降低了总成本。研究发现,为特定地区的净化厂选择最佳的可再生能源,应考虑一些重要的决定性因素,如水的盐度、偏远地区、工厂规模、工厂的技术基础设施、容量因素、能源消耗和设备的资本成本。
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引用次数: 7
Evaluation of Medicinal Effects of Isoxazole Ring Isosteres on Zonisamide for Autism Treatment by Binding to Potassium Voltage-Gated Channel Subfamily D Member 2 (Kv 4.2) 通过结合钾电压门控通道亚家族D成员2 (Kv 4.2)评价异恶唑环异构体对唑尼沙胺治疗自闭症的疗效
Pub Date : 2020-06-01 DOI: 10.33945/SAMI/AJCA.2020.4.8
M. Nabati, Vida Bodaghi-Namileh
The present research study discusses discovery of the novel drugs based on Zonisamide (FDA-approved drug) to treat the autism disease. We designed novel compounds by changing the pyrazole ring of the molecular structure with its isosteric rings. The main goal of the present study is evaluation of isosterism effect on Zonisamide compound. The studied pyrazole isosters are isothiazole, [c] azaphosphole, [d] azaphosphole, oxaphosphole, thiaphosphole and diphosphole. First, all designed molecular structures were optimized using density functional theory (DFT) computational method by B3LYP/6-311++G(d,p) basis set of theory. All the computations were performed in isolated form at room temperature. Then, making complex of all optimized molecular structures with A-type potassium voltage gated subfamily d member 2 (Kv 4.2) was studied. The ligand-receptor complexes energy data showed all designed molecules except (1H-indazol-3-yl)methanesulfonamide interct with channel weakly. The residues Phe 75, Asp 86, Phe 84, and Phe 74 played main role in making complex with (1H-indazol-3-yl)methanesulfonamide. However, the ADME and biological properties of the designed molecules were carried out using swissADME and FAF-Drugs4 web tools. Based on the ligand-channel complexes docking data and biochemical properties of the compounds, the pyrazole pentet ring is a suitable isostere for isoxazole ring in Zonisamide.
本研究探讨了以唑尼沙胺(fda批准的药物)为基础的治疗自闭症的新药的发现。我们通过将分子结构中的吡唑环改为等构环来设计新的化合物。本研究的主要目的是评价唑尼沙胺化合物的等构效应。所研究的吡唑同分异构体有异噻唑、[c]氮磷孔、[d]氮磷孔、草磷孔、硫磷孔和二磷孔。首先,采用B3LYP/6-311++G(d,p)基理论集的密度泛函理论(DFT)计算方法对所有设计的分子结构进行优化。所有计算均在室温下以孤立形式进行。然后,研究了所有优化分子结构与a型钾电压门控亚族d成员2 (Kv 4.2)的配合物。配体-受体配合物的能量数据表明,除(1h -茚唑-3-酰基)甲磺酰胺外,设计的分子与通道的相互作用较弱。氨基酸残基Phe 75、Asp 86、Phe 84和Phe 74在与(1h -吲哚-3-酰基)甲磺酰胺络合物的合成中起主要作用。然而,设计的分子的ADME和生物学特性是使用swissADME和FAF-Drugs4网络工具进行的。根据配体-通道配合物对接数据和化合物的生化性质,吡唑五环是唑尼沙胺中异恶唑环的合适异构体。
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引用次数: 5
Thermotropic Liquid Crystalline Polyesters Using Aromatic Rigid Diols, Unsaturated Fumaric Acid and Flexible Sebacic Acid 由芳香刚性二醇、不饱和富马酸和柔性癸二酸组成的热致液晶聚酯
Pub Date : 2020-06-01 DOI: 10.33945/SAMI/AJCA.2020.4.12
Apparav Wale, S. A. Mule, A. Dhage, K. Mulani, S. Ponrathnam, N. Chavan
In the present study, seven different series of thermotropic liquid crystalline polyesters (TLCPs) containing unsaturated fumaroyl chloride and flexible sebacoyl chloride were synthesized using the interfacial polymerization methodology. Homopolyesters prepared with saturated flexible spacer such as sebacoyl chloride were mesomorphic whereas homopolyesters synthesized using unsaturated aliphatic spacer such as fumaroyl chloride that was non-mesomorphic. Aromatic diad and triad based mesogenic diols were selected as rigid moiety for liquid crystalline phase formation. Within each series, copolyesters were synthesized by varying relative mole ratio of the above two aliphatic diacid chlorides. Most of the liquid crystalline polyesters showed solubility in phenol:tetrachloroethane (60:40) at 40 ᵒC.
采用界面聚合法制备了含不饱和富马酰氯和柔性皮脂酰氯的7个不同系列的热致性液晶聚酯(TLCPs)。用饱和柔性间隔剂(如皮脂酰氯)制备的均聚酯是亚对称的,而用不饱和脂肪族间隔剂(如富马酰氯)合成的均聚酯是非亚对称的。选择芳香二醇和三醇基介生二醇作为液晶相形成的刚性部分。在每个系列中,通过改变上述两种脂肪族二酸氯化物的相对摩尔比合成共聚酯。大多数液晶聚酯在40°C时与苯酚:四氯乙烷(60:40)具有溶解度。
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引用次数: 0
Heavy Metal Release from Industrial Solid Wastes (Case Study: Khazar Steel Smelting Plant) 工业固体废物释放重金属(以哈扎尔炼钢厂为例)
Pub Date : 2020-05-01 DOI: 10.33945/sami/ajca.2020.3.11
Zahra Zamiraei, M. Panahandeh, Habib Fathidokht
Information about the heavy metals release from industrial solid wastes is important for more reliable management of their environmental hazards. This study was conducted to investigate the effect of tissue of solid waste on the release of heavy metals from the steel smelting plant. After the investigation at the Khazar steel smelting (KSS) plant in Guilan province, its waste type, source, quantity and quality were characterized. The major wastes generated from the KSS plant were characterized to be the slag, furnace dust, and spent refractories. KSS solid wastes contained heavy metals in varying amounts, with the ranges of 1500-2200, 80–114, 6172-11100, 88-82, 48-29, 56-60, 4-14, 144-370 and 0.9-1.0 mg/kg−1 for Mn, Cu, Zn, Ni, Cr, Co, Cd, Pb and As, respectively. The concentration of the iron was high in these wastes (109900-672000 mg/kg−1). The results confirmed the high concentration of heavy metals except for Arsenic. The TCLP results of the KSS dust and slag showed the almost all the heavy metals concentrations by the leaching test were lower than the detection limits except Fe (524.5-187.6 mg/kg-1) and Mn (14-10.10 mg/kg-1). According to the results, all the wastes generated by the KSS plant were reusable and recyclable.
关于工业固体废物中重金属释放的信息对于更可靠地管理其环境危害具有重要意义。本研究旨在探讨固体废物组织对炼钢厂重金属排放的影响。通过对桂兰哈扎尔炼钢厂的调查,分析了该厂废弃物的种类、来源、数量和质量。KSS厂产生的主要废物是炉渣、炉灰和废耐火材料。KSS固体废物中重金属含量不同,Mn、Cu、Zn、Ni、Cr、Co、Cd、Pb和As的含量分别为1500 ~ 2200、80 ~ 114、6172 ~ 11100、88 ~ 82、48 ~ 29、56 ~ 60、4 ~ 14、144 ~ 370和0.6 ~ 1.0 mg/kg−1。这些废物中铁的浓度很高(109900-672000 mg/kg−1)。结果证实,除砷外,其他重金属浓度较高。KSS粉尘和矿渣的TCLP结果显示,除Fe (524.5 ~ 187.6 mg/kg-1)和Mn (14 ~ 10.10 mg/kg-1)外,其余重金属浓度均低于检测限。结果表明,KSS厂产生的废弃物均可重复利用和回收利用。
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引用次数: 0
10.33945/SAMI/AJCA.2020.1.10 10.33945 /萨米/ AJCA.2020.1.10
Pub Date : 2020-01-01 DOI: 10.33945/sami/ajca.2020.1.10
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引用次数: 1
Effect of Pure and Binary Azeotropic Fluids on Heat Pipes Performance 纯共沸流体和二元共沸流体对热管性能的影响
Pub Date : 2019-12-19 DOI: 10.33945/SAMI/AJCA.2020.5.2
Khalifa Bogarrasa, Moussa Khlifa
Azeotropic fluids are considered to be a beneficial discovery used in various operations involving mechanical performance of machines. It is the thermodynamic property of the fluids to absorb heat and dissipate it. For instance, the addition of alcohols in water may increase the performance of these fluids. The objective of this work was to conduct a comparative study on heat pipe performance with different working fluids. The working fluids chosen for the study were water and pure ethanol. The concentrations of ethanol in water differed between 25% and 95%. The material of heat pipes was copper with a sintered wicks structure. The experimental results revealed that, the evaporator temperature for water was lower than that of the ethanol and its mixture at high heating input. However, the heat transported by the heat pipes of water was considerably greater than that of the heat pipes of ethanol and binary fluids as working fluids.
共沸流体被认为是一个有益的发现,用于涉及机器机械性能的各种操作。流体的热力学性质是吸收热量并散发热量。例如,在水中添加酒精可以提高这些液体的性能。本工作的目的是对不同工质下热管的性能进行比较研究。本研究选用的工质为水和纯乙醇。水中乙醇的浓度在25%到95%之间。热管的材料为烧结芯结构的铜。实验结果表明,在高加热输入条件下,水的蒸发器温度低于乙醇及其混合物的蒸发器温度。然而,作为工质的水的热管所传递的热量要比乙醇和二元流体的热管大得多。
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引用次数: 3
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Advanced Journal of Chemistry-Section A
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