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Effect of molar concentration and drying methodologies on monodispersed silica sol for synthesis of silica aerogels with temperature-resistant characteristics 摩尔浓度和干燥方法对用于合成具有耐温特性的二氧化硅气凝胶的单分散硅溶胶的影响
Pub Date : 2024-01-01 DOI: 10.1016/j.mseb.2023.117062
D. Panda, A. Sahu, Krunal M. Gangawane
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引用次数: 0
Evaluation of thermal stresses on thin Al and AZO films deposited on polyethylene terephthalate substrates for flexible electronics applications 评估沉积在聚对苯二甲酸乙二醇酯基底上的铝和 AZO 薄膜在柔性电子应用中的热应力
Pub Date : 2024-01-01 DOI: 10.1016/j.mseb.2023.117056
Mohammad M. Hamasha, Ala H. Bani-Irshid, Sa'd Hamasha, Adnan Masadeh
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引用次数: 0
Molecular modeling of Si60 fullerene and Nb-doped Si60 fullerene nanomaterials for SO2, NO2 and CO2 gas sensing 用于二氧化硫、二氧化氮和二氧化碳气体传感的 Si60 富勒烯和掺钕 Si60 富勒烯纳米材料的分子建模
Pub Date : 2024-01-01 DOI: 10.1016/j.mseb.2023.117022
E. Agwamba, Maxwell-Borjor A. Eba, I. Alshdoukhi, Ali Shawabkeh, Ismail Hossain, O. J. Ikenyirimba, Gideon E. Mathias, T. Unimuke, Adedapo S. Adeyinka, H. Louis
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引用次数: 0
Adsorption of sulfadiazine on novel bilayer porous resin: Synergism of micropore filling and anion exchange 新型双层多孔树脂对磺胺嘧啶的吸附:微孔填充与阴离子交换的协同作用
Pub Date : 2023-11-28 DOI: 10.1016/j.mseb.2023.117039
Wei Sun, Guqing Xiao, Qiudong Meng

A novel bilayer porous resin with micropore filling and anion exchange (PsCH2BP) was synthesized. The aim was to investigate the adsorption of sulfadiazine on PsCH2BP. The micropore area of PsCH2BP was reduced by 73.91 % after the adsorption of sulfadiazine. PsCH2BP exhibited the synergism of micropore filling and anion exchange in the adsorption of sulfadiazine. Within the pH range of 7.29–13.31, the adsorption capacity trend of sulfadiazine on PsCH2BP was consistent with its ionization curve of pka 6.48. The adsorption of sulfadiazine on PsCH2BP was endothermic, spontaneous, entropy increase and heterogeneous multilayer adsorption, reflecting the bilayer pore structure of PsCH2BP. 100 % C2H5OH and 4 % NaCl could desorb 75.13 % and 65.06 % of sulfadiazine adsorbed on PsCH2BP, respectively, reflecting the synergism of the micropore filling and anion exchange in the adsorption of sulfadiazine on PsCH2BP. 100 % of desorption ratio of sulfadiazine adsorbed by PsCH2BP was achieved with 4 mol/LNaOH.

合成了一种具有微孔填充和阴离子交换功能的双层多孔树脂(PsCH2BP)。目的是研究磺胺嘧啶在PsCH2BP上的吸附。吸附磺胺嘧啶后,PsCH2BP的微孔面积减少了73.91%。PsCH2BP在吸附磺胺嘧啶过程中表现出微孔填充和阴离子交换的协同作用。在pH为7.29 ~ 13.31的范围内,磺胺嘧啶在PsCH2BP上的吸附量趋势与pka 6.48的电离曲线一致。磺胺嘧啶在PsCH2BP上的吸附是吸热、自发、熵增和非均相的多层吸附,反映了PsCH2BP的双层孔结构。100% C2H5OH和4% NaCl对吸附在PsCH2BP上的磺胺嘧啶的解吸率分别为75.13%和65.06%,反映了微孔填充和阴离子交换对PsCH2BP吸附磺胺嘧啶的协同作用。在4 mol/LNaOH条件下,PsCH2BP对磺胺嘧啶的解吸率达到100%。
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引用次数: 0
Long range push-pull based NIR switching and photovoltaic optimization as energetic offset novel study design of novel quinazoline anchoring dyes 基于长距离推挽的近红外开关和光伏优化作为能量补偿的新型喹唑啉锚定染料研究设计
Pub Date : 2023-11-28 DOI: 10.1016/j.mseb.2023.117050
Abrar U. Hassan, Sajjad H. Sumrra, Ayesha Mohyuddin, Muhammad Imran

This study investigates the photovoltaic (PV) properties, their energetic offset correlations of quinazoline-based push-pull switches. It finds an interesting correlation between their band-gaps and the rotational velocities with a linear fit value of 0.78. Also, their larger positive offsets up to 1011 by their open circuit voltage (Voc) tend to facilitated their efficient electron injection, leading to an improved photocurrent generation for device performance. Through push-pull phenomenon, a highest λmax of 574 nm was attained for the dye T5. Their PV performance of the was calculated as Voc, short circuit current (Jsc), and light harvesting efficiency (LHE) as 0.05–0.81 eV, 28.52–40.10 mA/cm2 and 0.65–0.87 respectively. Their transition density matrix (TDM) maps showed an enhancement of electron injection with the use of a more intense electron acceptor. This study advances understanding of the PV properties of quinazoline-based switches for developing PV devices. Their further research can lead to high-performance PV systems.

本文研究了基于喹唑啉的推挽开关的光伏(PV)特性及其能量偏移相关性。它发现它们的带隙与转速之间存在有趣的相关性,线性拟合值为0.78。此外,由于开路电压(Voc),它们的正偏移量高达1011,这有利于它们有效的电子注入,从而改善了器件性能的光电流产生。通过推挽现象,染料T5的λmax最高可达574 nm。其光伏性能分别为Voc 0.05 ~ 0.81 eV,短路电流(Jsc) 28.52 ~ 40.10 mA/cm2和LHE (LHE) 0.65 ~ 0.87。它们的跃迁密度矩阵(TDM)图显示,使用更强的电子受体可以增强电子注入。这项研究促进了对喹唑啉基开关的PV特性的理解,为开发PV器件提供了基础。他们进一步的研究可以带来高性能的光伏系统。
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引用次数: 0
Preparation and characterization of groove-shaped Ti/Cu layered electrode with superior hydrogen evolution performance 具有优异析氢性能的凹槽状Ti/Cu层状电极的制备与表征
Pub Date : 2023-11-28 DOI: 10.1016/j.mseb.2023.117060
Wei Sun, Jincheng Yang, Jing Wen, Wanjun Mao, Minghan Yang, Pengfei Han

In this study, a comprehensive investigation on the performance of laminated electrodes for hydrogen evolution reaction (HER) is conducted using experiments and numerical simulation. A laminated composite electrode with superior catalytic activity is designed, synthesized and tested, which is comparably researched with traditional homogeneous electrodes. A Ti/Cu laminated electrode with a slot width of 250 µm is fabricated by explosive welding and an electrochemical corrosion process is applied to create groove-shaped interface. The results show that the grooved laminated electrode has superior hydrogen precipitation performance and conductivity, exceptional stability, and minimal potential fluctuation. Hydrogen production efficiency of laminated electrode is 120% higher than that of Cu electrode, which is verified in our self-made hydrogen-making device. COMSOL simulation results were found to be consistent with the experimental findings. Overall, this study provides valuable insight into enhancing electrode performance, with broad engineering implications.

本文采用实验和数值模拟的方法对层压电极的析氢性能进行了全面的研究。设计、合成并测试了一种具有优异催化活性的层状复合电极,并与传统的均质电极进行了比较研究。采用爆炸焊接法制备槽宽为250µm的Ti/Cu层压电极,并采用电化学腐蚀工艺形成凹槽状界面。结果表明,该沟槽层合电极具有优异的析氢性能和导电性,优异的稳定性和极小的电位波动。层压电极的制氢效率比铜电极高120%,并在自制制氢装置中得到验证。COMSOL模拟结果与实验结果一致。总的来说,这项研究为提高电极性能提供了有价值的见解,具有广泛的工程意义。
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引用次数: 0
High performance vertical organic phototransistor doped with MXene 掺MXene的高性能垂直有机光电晶体管
Pub Date : 2023-11-28 DOI: 10.1016/j.mseb.2023.117054
Shaomin Chen, Zenan Lin, Huipeng Chen

Organic phototransistors are leading the development of next-generation wearable, monitoring, imaging, and sensing technologies due to their light weight, low cost, high yield, compatibility with flexible substrates, and customizable methods for synthesizing optoelectronic properties. However, the long channel length of conventional planar structures, usually in the micron range, greatly reduces the carrier transport efficiency and leads to an increased probability of defect trapping and complex recombination of photogenerated carriers. Here, an organic phototransistor with a vertical channel structure has been demonstrated, in which the active layer is blended with Mxene. Due to the short channel length of vertical structure, the recombination possibility of photogenerated excitons is reduced, and the high ultraviolet sensitivity of Mxene increases the bandwidth of detection. The device exhibits excellent photodetection performance with the photosensitivity of 4.28 × 106, photoresponsivity of 2.39 × 104 A/W, detectivity of 1.04 × 1017 Jones under irradiation with weak light of 8 μW cm−2 at 365 nm. This work paves the way for the study of transistors scale and high-performance organic photodetection in the future.

有机光电晶体管由于其重量轻、成本低、产量高、与柔性衬底兼容以及可定制的合成光电特性的方法,正在引领下一代可穿戴、监测、成像和传感技术的发展。然而,传统平面结构的长通道长度通常在微米范围内,这大大降低了载流子的传输效率,并导致缺陷捕获的可能性增加和光生载流子的复杂重组。本文展示了一种具有垂直沟道结构的有机光电晶体管,其中有源层与Mxene混合。由于垂直结构的通道长度较短,降低了光生激子的重组可能性,并且Mxene的高紫外灵敏度增加了探测带宽。该器件在365 nm弱光照射下,光敏度为4.28 × 106,光响应度为2.39 × 104 A/W,探测率为1.04 × 1017 Jones。这项工作为未来晶体管尺度和高性能有机光探测的研究铺平了道路。
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引用次数: 0
Electromagnetic wave absorption of fabricated Fe/Fe3O4/C hollow fibers derived from ceiba fiber templates 木棉纤维模板制备Fe/Fe3O4/C中空纤维的电磁波吸收
Pub Date : 2023-11-27 DOI: 10.1016/j.mseb.2023.117057
Shuting Yuan, Tianchi Wang, Tian Feng, Jian Kong

Electromagnetic-wave-absorbing fibers have been proposed as a method for addressing electromagnetic wave pollution. In this study, Fe/Fe3O4/C hollow electromagnetic wave absorbers were prepared using hollow ceiba fibers as templates. The ceiba fibers were immersed in an Fe(NO3)3 solution and sintered in argon to obtain Fe/C or Fe3O4/C hollow fibers with biochar. The wave absorption performance of the proposed Fe/Fe3O4/C hollow fibers was generally better than that of standard solid fibers. A minimum reflection loss of − 40.1 dB and an optimal effective bandwidth of 3.26 GHz were obtained. The proposed hollow structure could make the incident electromagnetic waves reflect and scatter many times, which led to significant electromagnetic wave energy consumption. Moreover, the impedance matching of magnetic materials, such as iron and its oxides, could be adjusted using the biochar of ceiba so that magnetic and dielectric losses work together to absorb electromagnetic waves.

电磁波吸收纤维被认为是解决电磁波污染的一种方法。本研究以空心木棉纤维为模板,制备了Fe/Fe3O4/C空心电磁波吸波器。将木棉纤维浸泡在Fe(NO3)3溶液中,在氩气中烧结,得到含生物炭的Fe/C或Fe3O4/C中空纤维。所制备的Fe/Fe3O4/C中空纤维的吸波性能普遍优于标准固体纤维。最小反射损耗为- 40.1 dB,最佳有效带宽为3.26 GHz。所提出的空心结构可以使入射电磁波多次反射和散射,从而导致电磁波能量的显著消耗。此外,可以利用木棉生物炭调节磁性材料(如铁及其氧化物)的阻抗匹配,使磁性和介电损耗共同吸收电磁波。
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引用次数: 0
Exploration of optoelectronic, thermodynamic, and thermoelectric properties of RFeO3 (R = Pr, Nd) perovskites RFeO3 (R = Pr, Nd)钙钛矿光电、热力学和热电性质的探索
Pub Date : 2023-11-26 DOI: 10.1016/j.mseb.2023.117044
Preeti Kumari, Vipul Srivastava, Ramesh Sharma, Hamid Ullah

We have investigated the rare-earth ferrites perovskite RFeO3 (R = Pr, Nd) for their structural, electronic, magnetic, optical, thermodynamic, and thermoelectric behavior using DFT as incorporated in WIEN2K software package. We have used FPLAPW method with exchange–correlation potentials: GGA, mBJ, and mBJ + U for investigating the current problem. For electronic properties, we have studied the band profile, density of states, and electronic density of RFeO3. The band profile of RFeO3 comes out to be half-metallic in mBJ + U. Further, optical properties have been computed corresponding to photon energy (0–10 eV). Thermodynamic examination of these compounds is performed using the Quasi-Harmonic Debye model. Consequently, the thermodynamic parameters' variation has been examined with temperature (0–1200 K) as well as pressure (0–40 GPa). Finally, we have evaluated the thermoelectric parameters using BoltzTrap code, and their variation with temperature (50–1200 K) and chemical potential (−2 to 2 eV) has been presented. We have obtained a maximum thermoelectric efficiency of 0.38 for PrFeO3 perovskite, and it is found that it increases with temperature. These materials are suitable to be used as a source in spintronic devices and UV absorbers.

我们利用WIEN2K软件包中的DFT研究了稀土铁氧体钙钛矿RFeO3 (R = Pr, Nd)的结构、电子、磁性、光学、热力学和热电行为。我们采用交换相关势为GGA、mBJ和mBJ + U的FPLAPW方法来研究当前问题。在电子性质方面,我们研究了RFeO3的能带分布、态密度和电子密度。RFeO3在mBJ + u中的能带谱为半金属,并计算了对应于光子能量(0-10 eV)的光学性质。这些化合物的热力学检验是用准调和德拜模型进行的。因此,热力学参数随温度(0-1200 K)和压力(0-40 GPa)的变化进行了研究。最后,我们用BoltzTrap代码计算了热电参数,并给出了它们随温度(50-1200 K)和化学势(- 2至2 eV)的变化。我们获得了PrFeO3钙钛矿的最大热电效率为0.38,并且发现它随着温度的升高而增加。这些材料适合用作自旋电子器件和紫外线吸收器的光源。
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引用次数: 0
CO2 adsorption properties of Ni-BDC MOF and its 1–8 wt% g-C3N4/Ni-BDC MOF Ni-BDC MOF及其1-8 wt% g-C3N4/Ni-BDC MOF的CO2吸附性能
Pub Date : 2023-11-26 DOI: 10.1016/j.mseb.2023.117043
Muhammad Haris Azhar, Tayyaba Noor, Naseem Iqbal, Neelam Zaman, Sarah Farrukh

The substantial challenge that the world is facing nowadays, is the increase in greenhouse gasses which causes global warming. Therefore, there must be a technique to overcome its global emission rate. Accordingly, many absorbents and adsorption techniques are used to capture the CO2 gas. Here, this study reports a novel class of adsorbents Metal Organic Framework (MOF) and its g-C3N4 based composites are used to adsorb CO2. The synthesis of Ni-BDC MOF and its 1–8 wt% g-C3N4/Ni-BDC MOF composites were successfully prepared via the solvothermal method. These samples are characterized by using different techniques like XRD, EDX, SEM, FTIR to investigate the structural and morphological properties. The MOFs and their composites were studied for CO2 adsorption and desorption at a temperature of 25 °C and 0–15 bar pressure. Among all the composites, 5 wt% g-C3N4/Ni-BDC MOF shows the highest adsorption capacity of 0.50 mmol/g. The rising adsorption trend of all prepared materials shows that these samples do not reach their saturation point and can still adsorb more CO2 even at pressure higher than 15 bar.

当今世界面临的重大挑战是导致全球变暖的温室气体的增加。因此,必须有一种技术来克服其全球排放率。因此,许多吸收剂和吸附技术被用来捕获二氧化碳气体。本文报道了一类新型吸附剂金属有机骨架(MOF)及其g-C3N4基复合材料用于吸附CO2。采用溶剂热法成功合成了Ni-BDC MOF及其1 - 8wt % g-C3N4/Ni-BDC MOF复合材料。采用XRD、EDX、SEM、FTIR等技术对样品进行了表征,研究了样品的结构和形态特征。研究了mof及其复合材料在温度为25℃、压力为0 ~ 15 bar条件下对CO2的吸附和解吸性能。5 wt% g- c3n4 /Ni-BDC MOF的吸附量最高,为0.50 mmol/g。所有制备的材料的吸附都呈上升趋势,表明这些样品在高于15 bar的压力下仍未达到饱和点,仍然可以吸附更多的CO2。
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引用次数: 0
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Materials Science and Engineering: B
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