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Study on the mechanism of photocatalytic activity enhancement of Ag/Ag3PO4/PDI-2 supramolecular Z-scheme heterojunction photocatalyst Ag/Ag3PO4/PDI-2 超分子 Z 型异质结光催化剂光催化活性增强机理研究
IF 3.9 3区 材料科学 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2024-11-17 DOI: 10.1016/j.mseb.2024.117845
Congzhi Hu, Yuye Li, Tingting Du, Youyong Pang, Yongping Liu, Botian Liu, Ling Li, Huidan Lu, Bin Huang
In this paper, a new supramolecular Z-scheme heterojunction photocatalyst, designated as Ag/Ag3PO4/Perylene diimide organic molecules after secondary acid-base self-assembly (PDI-2), was synthesized through precipitation and photoreduction techniques. Ag/Ag3PO4/60 %PDI-2 (APP-6) exhibited the best photocatalytic activity due to the synergistic effect of Z-scheme heterojunction and surface plasmon resonance (SPR) effect of Ag nanoparticles (Ag NPs). Under visible light (λ > 420 nm), the degradation efficiency of APP-6 for Rhodamine B (RhB) and Bisphenol A (BPA) was 99.7 % and 90.7 %, respectively. Additionally, PDI-2 was transformed into smaller nanoclusters, which increased the specific surface area of the photocatalyst, and reduced the charge transport distance. Moreover, APP-6 exhibited the smallest electrochemical impedance, the largest photocurrent, the smallest fluorescence lifetime. Free radical trapping experiments showed that •O2 was the main reactive group and a possible photocatalytic mechanism was proposed by combining the Ultraviolet–visible diffuse reflectance spectrophotometer (UV–vis DRS) and the Mott-Schottky plots.
本文通过沉淀和光还原技术合成了一种新型超分子 Z 型异质结光催化剂,命名为 Ag/Ag3PO4/Perylene diimide organic molecules after secondary acid-base self-assembly (PDI-2)。由于 Z 型异质结的协同效应和银纳米粒子(Ag NPs)的表面等离子体共振(SPR)效应,Ag/Ag3PO4/60 %PDI-2 (APP-6)表现出最佳的光催化活性。在可见光(λ > 420 nm)条件下,APP-6对罗丹明B(RhB)和双酚A(BPA)的降解效率分别为99.7%和90.7%。此外,PDI-2 转化为更小的纳米团簇,增加了光催化剂的比表面积,并缩短了电荷传输距离。此外,APP-6 的电化学阻抗最小、光电流最大、荧光寿命最短。自由基捕获实验表明 -O2- 是主要的反应基团,并结合紫外可见光漫反射分光光度计(UV-vis DRS)和 Mott-Schottky 图提出了可能的光催化机理。
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引用次数: 0
Effect of temperature and capillary number on wettability and contact angle hysteresis of various materials. Modeling taking into account porosity 温度和毛细管数对各种材料润湿性和接触角滞后的影响考虑孔隙率的建模
IF 3.9 3区 材料科学 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2024-11-17 DOI: 10.1016/j.mseb.2024.117827
S.Y. Misyura , V.S. Morozov , V.A. Andryushchenko , E.G. Orlova
The effect of surface temperature and laser texturing on the wettability and contact angle hysteresis of Cu, Cu/G, AlMg3, Cu-SiC was considered. Modeling using molecular dynamics qualitatively confirms the experimental results: 1) an increase in the contact angle hysteresis on a textured surface; 2) influence of the surface wettability on contact angle hysteresis; 3) influence of the contact line velocity on contact angle hysteresis. Heating the sample of different composite materials can lead to either an increase in the contact angle or a decrease. It was shown that after laser texturing, a system of nano-micro pores was formed in the surface layer of the material, which leads to an abnormally high contact angle hysteresis on the Cu-SiC composite. A new model is proposed that explains the different qualitative behavior of the contact angle hysteresis in different studies with increasing capillary number (Ca), as well as with increasing sample temperature.
研究考虑了表面温度和激光纹理对铜、Cu/G、AlMg3、Cu-SiC 的润湿性和接触角滞后的影响。分子动力学建模定性地证实了实验结果:1)纹理表面的接触角滞后增加;2)表面润湿性对接触角滞后的影响;3)接触线速度对接触角滞后的影响。加热不同复合材料的样品会导致接触角增大或减小。研究表明,激光纹理加工后,材料表层形成了纳米微孔系统,这导致铜-碳化硅复合材料的接触角滞后异常高。本文提出了一个新模型,用于解释不同研究中接触角滞后随毛细管数(Ca)增加以及样品温度升高而产生的不同定性行为。
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引用次数: 0
Biocompatible Mn and Cu dual-doped ZnS nanosheets for enhanced the photocatalytic activity under sunlight irradiation for wastewater treatment and embedded with PVA polymer for reusability 生物相容性锰铜双掺杂 ZnS 纳米片在阳光照射下增强光催化活性,用于废水处理,并嵌入 PVA 聚合物以实现重复使用
IF 3.9 3区 材料科学 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2024-11-17 DOI: 10.1016/j.mseb.2024.117837
S. Murugan, M. Ashokkumar
This study investigates the synthesis of Mn and Cu-doped ZnS nanosheets via the coprecipitation method, focusing on their structural, optical, photocatalytic, and hemolytic properties. XRD analysis confirmed a cubic structure, with crystallite size decreasing as doping levels increased. TEM identified crumpled nanosheets, while UV–Vis spectroscopy measured bandgaps of 3.98, 3.78, 3.93, and 4.09 eV for the ZM1, ZM2, ZM3, and ZM4 samples, respectively. The ZM3 nanosheets exhibited superior photocatalytic performance, achieving 99 % dye degradation in 110 min under sunlight. Kinetic analysis showed a rate constant of 46.91 × 10−3 min−1 for ZM3. When embedded in a PVA polymer membrane, the ZM3 nanosheets demonstrated 95 % degradation efficiency and excellent reusability. The study also explored the degradation mechanism, effects of dosage and dye variation, and hemolytic activity on human red blood cells, providing a comprehensive understanding of these doped ZnS nanosheets.
本研究通过共沉淀法合成了掺锰和掺铜的 ZnS 纳米片,重点研究了它们的结构、光学、光催化和溶血特性。XRD 分析证实其为立方结构,晶体尺寸随着掺杂水平的增加而减小。TEM 鉴定出了皱褶纳米片,而紫外可见光谱测量出 ZM1、ZM2、ZM3 和 ZM4 样品的带隙分别为 3.98、3.78、3.93 和 4.09 eV。ZM3 纳米片具有优异的光催化性能,在阳光下 110 分钟内实现了 99% 的染料降解。动力学分析表明,ZM3 的速率常数为 46.91 × 10-3 min-1。当将 ZM3 纳米片嵌入 PVA 聚合物膜中时,降解效率达到 95%,并具有良好的可重复使用性。该研究还探讨了降解机制、剂量和染料变化的影响以及对人类红细胞的溶血活性,从而全面了解了这些掺杂 ZnS 纳米片。
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引用次数: 0
A comparative study on the lamella effect and properties of atomized iron powder and reduced iron powder in Fe-based soft magnetic composites 雾化铁粉和还原铁粉在铁基软磁复合材料中的层状效应和性能比较研究
IF 3.9 3区 材料科学 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2024-11-17 DOI: 10.1016/j.mseb.2024.117844
Zhenjia Yang , Zigui Luo , Qi Jin , Xi’an Fan , Zhaoyang Wu , Jian Wang , Guangqiang Li
We prepared Fe soft magnetic composites (SMCs) with lamellar structure by using the flaky Iron powder, and studied the effects of types of iron powder on the microstructure and properties of Fe SMCs. The results show that the atomized iron powder and the reduced iron powder are deformed into flaky structure after ball milling, and these flaky iron powder have greater magnetic susceptibility and eddy current diameter perpendicular to the magnetic flux direction. In addition, compared with flaky gas atomized iron powder, the flaky reduced iron powder has large aspect ratio and lower coercivity. Therefore, the Fe SMCs with flaky reduced iron powder exhibit relatively high permeability (82) and low eddy current loss (0.033 W/kg at 50 kHz, 0.05 T), which shows the potential possibility of application at high frequency.
我们利用片状铁粉制备了具有片状结构的铁基软磁复合材料(SMC),并研究了铁粉类型对铁基软磁复合材料微观结构和性能的影响。结果表明,雾化铁粉和还原铁粉在球磨后变形为片状结构,这些片状铁粉具有更大的磁感应强度和垂直于磁通方向的涡流直径。此外,与片状气体雾化铁粉相比,片状还原铁粉具有较大的长宽比和较低的矫顽力。因此,使用片状还原铁粉的铁 SMC 具有相对较高的磁导率(82)和较低的涡流损耗(50 kHz、0.05 T 时为 0.033 W/kg),这显示了在高频应用的潜在可能性。
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引用次数: 0
Synthesis and enhanced electrical properties of Ag-doped α-Fe2O3 nanoparticles in PVA films for nanoelectronic applications 用于纳米电子应用的 PVA 薄膜中掺杂 Ag 的 α-Fe2O3 纳米粒子的合成及其增强的电学特性
IF 3.9 3区 材料科学 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2024-11-17 DOI: 10.1016/j.mseb.2024.117801
S. Vijayaraghavan , A. Rajasekaran , Abdullah N Alodhayb , Muthumareeswaran Muthuramamoorthy , M. Vimalan , K. Ganesh Kumar
Rhombohedral α-Fe2O3 nanoparticles doped with silver (Ag-α-Fe2O3) were successfully synthesized using a hydrothermal method. The structural characteristics and morphology of the synthesized nanoparticles were examined using X-ray diffraction (XRD), Raman spectroscopy, and scanning electron microscopy (SEM), wherein the Raman peak was observed at 218/cm. The electrical properties of the Ag-doped α-Fe2O3 nanoparticles layered in polyvinyl alcohol (PVA) film were analyzed through I-V curves, impedance graphs, and measurements of dielectric constant (Ɛ) and dielectric loss (Ɛ′). Through the I-V curve, a current value of 3.68 × 10−2 μA was obtained, which was 52 % greater than that of the PVA film at an applied voltage of ± 100 V. The results demonstrated that the Ag-doped α-Fe2O3 in the PVA film exhibited enhanced electrical properties, with significant increases in both dielectric constant (0.5 × 103) and dielectric loss (11 × 103). Ag-doped α-Fe2O3 in PVA film, therefore, appears to be a promising applicants in Nano electronics.
采用水热法成功合成了掺银的斜方体α-Fe2O3 纳米粒子(Ag-α-Fe2O3)。利用 X 射线衍射 (XRD)、拉曼光谱和扫描电子显微镜 (SEM) 对合成纳米粒子的结构特征和形态进行了检测,其中在 218/cm 处观察到拉曼峰。通过 I-V 曲线、阻抗图以及介电常数(Ɛ)和介电损耗(Ɛ′)的测量,分析了分层在聚乙烯醇(PVA)薄膜中的掺银 α-Fe2O3 纳米粒子的电学特性。结果表明,在 PVA 薄膜中掺杂 Ag 的 α-Fe2O3 具有更强的电学特性,介电常数(0.5 × 103)和介电损耗(11 × 103)都显著增加。因此,在 PVA 薄膜中掺杂 Ag 的 α-Fe2O3 似乎是纳米电子学中一种前景广阔的应用。
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引用次数: 0
The effect of Mo and Sc dopants on the performance of an Sr2Fe2O6 cathode for use in proton-conducting solid oxide fuel cells 掺杂钼和钪对用于质子传导型固体氧化物燃料电池的 Sr2Fe2O6 阴极性能的影响
IF 3.9 3区 材料科学 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2024-11-16 DOI: 10.1016/j.mseb.2024.117836
Shu Yang, Yueyuan Gu, Shoufu Yu
Sr2Fe2O6 was doped with Sc and Mo ions to investigate the effect of these dopants on the material properties and cathode performance. Both Sc and Mo were doped into Sr2Fe2O6 as pure phases, and the thermal expansion coefficient (TEC) increased with the Sc content of the material. A first-principles calculation at the atomic level indicated that Mo facilitated hydration, whereas Sc doping facilitated the formation of oxygen vacancies. Simulation results showed that the lowest energy barrier to O2 adsorption and dissociation was obtained by co-doping Sc and Mo into Sr2Fe2O6, facilitating the cathode reaction. The results of fuel cell tests indicated that co-doping with Sc and Mo resulted in higher fuel-cell performance for Sr2Fe2O6 than doping with Sc or Mo alone. An impedance analysis for Sr2Fe2O6 co-doped with Sc and Mo indicated a good balance between hydration and oxygen vacancy formation, as well as a low energy barrier to O2 adsorption and dissociation, which resulted in this material exhibiting the lowest polarization resistance among the tested cathodes. This study demonstrates that each dopant has unique advantages and disadvantages in terms of cathode properties, and it is necessary to strike a balance among the parameters involved to enhance the cathode performance.
在 Sr2Fe2O6 中掺入了 Sc 和 Mo 离子,以研究这些掺杂剂对材料特性和阴极性能的影响。Sc和Mo均以纯相的形式掺入Sr2Fe2O6中,热膨胀系数(TEC)随材料中Sc含量的增加而增大。原子层面的第一原理计算表明,钼促进了水合作用,而掺入钪则促进了氧空位的形成。模拟结果表明,通过在 Sr2Fe2O6 中共同掺杂 Sc 和 Mo,可获得最低的氧气吸附和解离能垒,从而促进阴极反应。燃料电池测试结果表明,与单独掺杂 Sc 或 Mo 相比,共同掺杂 Sc 和 Mo 使 Sr2Fe2O6 具有更高的燃料电池性能。对掺杂了 Sc 和 Mo 的 Sr2Fe2O6 进行的阻抗分析表明,该材料在水化和氧空位形成之间取得了良好的平衡,而且氧气吸附和解离的能量障碍较低,因此在测试的阴极中,该材料的极化电阻最低。这项研究表明,每种掺杂剂在阴极性能方面都有其独特的优缺点,因此有必要在相关参数之间取得平衡,以提高阴极的性能。
{"title":"The effect of Mo and Sc dopants on the performance of an Sr2Fe2O6 cathode for use in proton-conducting solid oxide fuel cells","authors":"Shu Yang,&nbsp;Yueyuan Gu,&nbsp;Shoufu Yu","doi":"10.1016/j.mseb.2024.117836","DOIUrl":"10.1016/j.mseb.2024.117836","url":null,"abstract":"<div><div>Sr<sub>2</sub>Fe<sub>2</sub>O<sub>6</sub> was doped with Sc and Mo ions to investigate the effect of these dopants on the material properties and cathode performance. Both Sc and Mo were doped into Sr<sub>2</sub>Fe<sub>2</sub>O<sub>6</sub> as pure phases, and the thermal expansion coefficient (TEC) increased with the Sc content of the material. A first-principles calculation at the atomic level indicated that Mo facilitated hydration, whereas Sc doping facilitated the formation of oxygen vacancies. Simulation results showed that the lowest energy barrier to O<sub>2</sub> adsorption and dissociation was obtained by co-doping Sc and Mo into Sr<sub>2</sub>Fe<sub>2</sub>O<sub>6</sub>, facilitating the cathode reaction. The results of fuel cell tests indicated that co-doping with Sc and Mo resulted in higher fuel-cell performance for Sr<sub>2</sub>Fe<sub>2</sub>O<sub>6</sub> than doping with Sc or Mo alone. An impedance analysis for Sr<sub>2</sub>Fe<sub>2</sub>O<sub>6</sub> co-doped with Sc and Mo indicated a good balance between hydration and oxygen vacancy formation, as well as a low energy barrier to O<sub>2</sub> adsorption and dissociation, which resulted in this material exhibiting the lowest polarization resistance among the tested cathodes. This study demonstrates that each dopant has unique advantages and disadvantages in terms of cathode properties, and it is necessary to strike a balance among the parameters involved to enhance the cathode performance.</div></div>","PeriodicalId":18233,"journal":{"name":"Materials Science and Engineering B-advanced Functional Solid-state Materials","volume":"311 ","pages":"Article 117836"},"PeriodicalIF":3.9,"publicationDate":"2024-11-16","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142656987","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Synthesis, characterization, and application of Ba3V2O8 ceramics in cylindrical dielectric resonator antenna: Simulation and experimental study 圆柱形介质谐振器天线中 Ba3V2O8 陶瓷的合成、表征和应用:仿真与实验研究
IF 3.9 3区 材料科学 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2024-11-16 DOI: 10.1016/j.mseb.2024.117791
M.A. Dinesh , Raghvendra Kumar , Vibha Rani Gupta , Vijaylakshmi Dayal
This study focuses on synthesizing dielectric ceramic material Ba3V2O8 (BVO) and its application in Cylindrical Dielectric Resonator Antennas (CDRAs) fabrication. The investigation involves a comprehensive parametric study combining software simulations and experimental validation to understand the performance characteristics of the CDRA using the synthesized material. The ceramics were sintered at 900 °C and 950 °C. X-ray diffraction (XRD) confirmed the phase formation, indicating a Rhombohedral structure with the space group R3¯m. Dielectric properties were characterized, revealing temperature-independent structures. The dielectric properties of BVO ceramics (BVO-900: εr=13.1, Q×f=4000, tanδ=0.00222, τf=0; BVO-950: εr=13, Q×f = 5000, tanδ=0.00173, τf=0) were utilized to model CDRAs using the High-Frequency Structure Simulator (HFSS) suite. The designs were optimized for effective performance and used to fabricate CDRAs, which were subsequently characterized using a network analyzer and a double-ridge horn antenna. The CDRA using BVO-900 exhibited resonance frequency (fr) = 8.06 GHz, S11 = -44.02 dB, Voltage Standing Wave Ratio (VSWR) = 1.07, and Bandwidth (BW) = 16.25 %, while the BVO-950-based antenna displayedfr = 8.09 GHz, S11 = -30.49 dB, VSWR = 1.06, and BW = 13.1 %. Measured values closely matched simulated values, demonstrating the effectiveness of the synthesized ceramics in CDRA applications.
本研究的重点是合成介电陶瓷材料 Ba3V2O8(BVO)及其在圆柱介质谐振器天线(CDRA)制造中的应用。这项研究包括一项综合参数研究,结合软件模拟和实验验证,以了解使用合成材料的 CDRA 的性能特征。陶瓷在 900 °C 和 950 °C 下烧结。X 射线衍射 (XRD) 证实了相的形成,显示出空间群为 R3¯m 的斜方体结构。介电性能表征显示了与温度无关的结构。利用 BVO 陶瓷(BVO-900:εr=13.1,Q×f=4000,tanδ=0.00222,τf=0;BVO-950:εr=13,Q×f=5000,tanδ=0.00173,τf=0)的介电特性,使用高频结构模拟器(HFSS)套件建立 CDRA 模型。对设计进行了有效性能优化,并用于制造 CDRA,随后使用网络分析仪和双脊喇叭天线对其进行了鉴定。使用 BVO-900 的 CDRA 显示共振频率 (fr) = 8.06 GHz、S11 = -44.02 dB、电压驻波比 (VSWR) = 1.07 和带宽 (BW) = 16.25 %,而基于 BVO-950 的天线显示频率 (fr) = 8.09 GHz、S11 = -30.49 dB、VSWR = 1.06 和带宽 = 13.1 %。测量值与模拟值非常吻合,证明了合成陶瓷在 CDRA 应用中的有效性。
{"title":"Synthesis, characterization, and application of Ba3V2O8 ceramics in cylindrical dielectric resonator antenna: Simulation and experimental study","authors":"M.A. Dinesh ,&nbsp;Raghvendra Kumar ,&nbsp;Vibha Rani Gupta ,&nbsp;Vijaylakshmi Dayal","doi":"10.1016/j.mseb.2024.117791","DOIUrl":"10.1016/j.mseb.2024.117791","url":null,"abstract":"<div><div>This study focuses on synthesizing dielectric ceramic material Ba<sub>3</sub>V<sub>2</sub>O<sub>8</sub> (BVO) and its application in Cylindrical Dielectric Resonator Antennas (CDRAs) fabrication. The investigation involves a comprehensive parametric study combining software simulations and experimental validation to understand the performance characteristics of the CDRA using the synthesized material. The ceramics were sintered at 900 °C and 950 °C. X-ray diffraction (XRD) confirmed the phase formation, indicating a Rhombohedral structure with the space group <span><math><mrow><mi>R</mi><mover><mrow><mn>3</mn></mrow><mrow><mo>¯</mo></mrow></mover><mi>m</mi></mrow></math></span>. Dielectric properties were characterized, revealing temperature-independent structures. The dielectric properties of BVO ceramics (BVO-900: <span><math><mrow><msub><mi>ε</mi><mi>r</mi></msub></mrow></math></span>=13.1, <span><math><mrow><mi>Q</mi><mo>×</mo><mi>f</mi></mrow></math></span>=4000, <span><math><mrow><mi>t</mi><mi>a</mi><mi>n</mi><mi>δ</mi></mrow></math></span>=0.00222, <span><math><mrow><msub><mi>τ</mi><mi>f</mi></msub></mrow></math></span>=0; BVO-950: <span><math><mrow><msub><mi>ε</mi><mi>r</mi></msub></mrow></math></span>=13, <span><math><mrow><mi>Q</mi><mo>×</mo><mi>f</mi></mrow></math></span> = 5000, <span><math><mrow><mi>t</mi><mi>a</mi><mi>n</mi><mi>δ</mi></mrow></math></span>=0.00173, <span><math><mrow><msub><mi>τ</mi><mi>f</mi></msub></mrow></math></span>=0) were utilized to model CDRAs using the High-Frequency Structure Simulator (HFSS) suite. The designs were optimized for effective performance and used to fabricate CDRAs, which were subsequently characterized using a network analyzer and a double-ridge horn antenna. The CDRA using BVO-900 exhibited resonance frequency (<span><math><mrow><msub><mi>f</mi><mi>r</mi></msub><mrow><mo>)</mo></mrow></mrow></math></span> = 8.06 GHz, S<sub>11</sub> = -44.02 dB, Voltage Standing Wave Ratio (VSWR) = 1.07, and Bandwidth (BW) = 16.25 %, while the BVO-950-based antenna displayed<span><math><mrow><msub><mi>f</mi><mi>r</mi></msub></mrow></math></span> = 8.09 GHz, S<sub>11</sub> = -30.49 dB, VSWR = 1.06, and BW = 13.1 %. Measured values closely matched simulated values, demonstrating the effectiveness of the synthesized ceramics in CDRA applications.</div></div>","PeriodicalId":18233,"journal":{"name":"Materials Science and Engineering B-advanced Functional Solid-state Materials","volume":"311 ","pages":"Article 117791"},"PeriodicalIF":3.9,"publicationDate":"2024-11-16","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142656983","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Comparative study of electronic, thermoelectric, and transport properties in germanene and carbon nanotubes 锗和碳纳米管的电子、热电和传输特性比较研究
IF 3.9 3区 材料科学 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2024-11-16 DOI: 10.1016/j.mseb.2024.117826
Somayeh Behzad
This study investigates the electronic, thermoelectric, and transport properties of Germanene nanotubes (GeNTs) using a tight-binding calculations and explores their potential advantages over carbon nanotubes (CNTs) in thermoelectric applications. The effect of external electric and magnetic fields, nanotube radius, and temperature on heat capacity, electrical conductivity, power factor, and Seebeck coefficient are systematically investigated. The heat capacity C(T) of GeNTs shows a more pronounced increase with the application of external fields, especially electric field and exceeds that of CNTs. GeNTs also exhibit a lower threshold temperature for non-zero electrical conductivity attributed to their smaller energy gap, which results from easier thermal excitation of charge carriers. This property becomes more pronounced as the electrical conductivity of GeNTs increases more rapidly with temperature than that of CNTs, particularly under stronger external fields. Additionally, the thermoelectric properties of GeNTs can be further enhanced under external fields. While CNTs possess higher Seebeck coefficients and Lorenz numbers, GeNTs demonstrate distinct advantages in tunable heat capacity and conductivity, making them promising candidates for efficient thermoelectric and nanoelectronic devices. These results underscore the potential of GeNTs as an effective alternative to CNTs for advanced energy conversion applications, demonstrating their promise as high-performance thermoelectric materials for energy conversion applications.
本研究采用紧密结合计算方法研究了格耳曼纳米管(GeNTs)的电子、热电和传输特性,并探讨了其在热电应用中相对于碳纳米管(CNTs)的潜在优势。系统研究了外部电场和磁场、纳米管半径和温度对热容量、电导率、功率因数和塞贝克系数的影响。GeNTs 的热容量 C(T) 在外加电场(尤其是电场)的作用下有更明显的增加,超过了 CNTs。GeNTs 还表现出较低的非零电导阈值温度,这归因于其较小的能隙,而能隙是电荷载流子更容易被热激发的结果。随着温度的升高,GeNT 的电导率比 CNT 的电导率上升得更快,尤其是在较强的外场条件下,这一特性变得更加明显。此外,在外加电场的作用下,GeNT 的热电特性还能进一步增强。虽然 CNTs 具有更高的塞贝克系数和洛伦兹数,但 GeNTs 在可调热容量和导电性方面具有明显优势,因此有望成为高效热电和纳米电子器件的候选材料。这些结果凸显了 GeNTs 作为先进能源转换应用中 CNTs 的有效替代品的潜力,表明它们有望成为能源转换应用中的高性能热电材料。
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引用次数: 0
Cobalt iron oxide (CoFe2O4) reinforced polyvinyl alcohol (PVA) based magnetoactive polymer nanocomposites for remote actuation 基于氧化钴(CoFe2O4)增强聚乙烯醇(PVA)的磁活性聚合物纳米复合材料,用于远程致动
IF 3.9 3区 材料科学 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2024-11-16 DOI: 10.1016/j.mseb.2024.117838
Ans Al Rashid , Noor A. Al-Maslamani , Anas Abutaha , Mokarram Hossain , Muammer Koç
Magnetoactive polymer composites (MAPCs) are materials composed of a polymer matrix embedded with magnetic particles that mechanically respond to external magnetic fields. MAPCs can be programmed to be adjusted remotely without physical interventions using a magnetic field to generate the desired response; therefore, MAPCs are being actively explored for their applications in remote sensing, soft robotics, electronics, and biomedical areas. In this work, novel MAPCs were synthesised comprising polyvinyl alcohol (PVA) as the matrix and cobalt iron oxide (CoFe2O4) nanoparticles as the magnetic component with varying concentrations (i.e., 1.25%, 2.5%, and 5%). MAPCs were synthesised using the solution casting technique, and field emission scanning electron microscopy (FE-SEM) and x-ray diffraction (XRD) results revealed the successful integration of CoFe2O4 nanoparticles within the polymer matrix. The synthesised MAPC films were also characterised for their chemical, thermal, magnetic, and biological properties. The incorporation of CoFe2O4 nanoparticles resulted in an improved magnetic and biological response, with improvements in these properties with increasing CoFe2O4 content. However, PVA/5% CoFe2O4 revealed toxicity and requires further investigation of using these materials with higher CoFe2O4 concentrations. The magnetic response and biological properties of the PVA/CoFe2O4 MAPCs revealed their potential uses for remote actuation and sensing in the biomedical sector.
磁活性聚合物复合材料(MAPC)是一种由聚合物基体和磁性颗粒组成的材料,可对外部磁场做出机械响应。MAPC 可通过编程进行远程调整,无需物理干预,利用磁场产生所需的响应;因此,MAPC 在遥感、软机器人、电子和生物医学领域的应用正受到积极探索。在这项工作中,合成了新型 MAPCs,它以聚乙烯醇(PVA)为基质,以不同浓度(即 1.25%、2.5% 和 5%)的氧化钴(CoFe2O4)纳米粒子为磁性成分。采用溶液浇铸技术合成了 MAPC,场发射扫描电子显微镜(FE-SEM)和 X 射线衍射(XRD)结果表明,CoFe2O4 纳米粒子成功地融入了聚合物基体。合成的 MAPC 薄膜还具有化学、热、磁和生物特性。CoFe2O4 纳米粒子的加入改善了磁性和生物反应,随着 CoFe2O4 含量的增加,这些特性也得到了改善。不过,PVA/5% CoFe2O4 显示出了毒性,因此需要进一步研究如何使用这些含有更高浓度 CoFe2O4 的材料。PVA/CoFe2O4 MAPCs 的磁响应和生物特性揭示了它们在生物医学领域远程驱动和传感方面的潜在用途。
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引用次数: 0
MXene decorated ZnO-tetrapod for efficient degradation of Methyl Orange, Methylene Blue, and Rhodamine B dyes 用于高效降解甲基橙、亚甲基蓝和罗丹明 B 染料的 MXene 装饰氧化锌四元结构
IF 3.9 3区 材料科学 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2024-11-16 DOI: 10.1016/j.mseb.2024.117832
Sahil Jangra , Azam Raza , Bhushan Kumar , Jaishree Sharma , Subhankar Das , Kailash Pandey , Yogendra Kumar Mishra , M.S. Goyat
For the first time, Methyl Orange (MO), Methylene Blue (MB), and Rhodamine B (RhB) dyes degradation using MXene decorated ZnO-tetrapod (MZT) has been reported. MXene was derived from MAX phase using HF etching and ZT was produced using flame transport synthesis (FTS) technique. MXene was decorated on ZT using blending and sonication of deionized water consisting of MXene and ZT. The MZT was characterized using X-ray diffraction (XRD), UV–visible spectroscopy, Tauc plot analysis, Brunauer-Emmett-Teller (BET) surface area measurement, field emission scanning electron microscopy (FESEM) and High-Resolution Transmission Electron Microscopy (HRTEM) to ensure the successful decoration. The dye degradation capability of the MZT was tested against three dyes: MO, MB, and RhB. Photodegradation tests under sunlight showed RhB had the highest efficiency (77.60 %), followed by MO (76.79 %) and MB (50.83 %), respectively. The kinetic rate constants confirmed RhB’s superior degradation. Furthermore, Electron paramagnetic resonance (EPR) spectroscopy revealed oxygen vacancies, enhancing photocatalytic performance. MZT maintained high efficiency, with less than 20 % loss after 4 cycles, demonstrating its potential for repeated use in wastewater treatment and environmental pollution mitigation. The results reveal the potential of MZT in photocatalytic degradation of harmful organic dyes, very promising solution for combating environmental pollution.
首次报道了使用 MXene 装饰的氧化锌四元结构(MZT)降解甲基橙(MO)、亚甲基蓝(MB)和罗丹明 B(RhB)染料。MXene 是通过高频蚀刻从 MAX 相中提取的,而 ZT 则是通过火焰传输合成(FTS)技术生产的。通过将 MXene 和 ZT 组成的去离子水混合和超声处理,在 ZT 上装饰了 MXene。使用 X 射线衍射 (XRD)、紫外可见光谱、陶氏图分析、布鲁诺-艾美特-泰勒 (BET) 表面积测量、场发射扫描电子显微镜 (FESEM) 和高分辨率透射电子显微镜 (HRTEM) 对 MZT 进行了表征,以确保装饰成功。针对三种染料测试了 MZT 的染料降解能力:MO、MB 和 RhB。日光下的光降解测试表明,RhB 的效率最高(77.60%),其次分别是 MO(76.79%)和 MB(50.83%)。动力学速率常数证实了 RhB 的卓越降解能力。此外,电子顺磁共振(EPR)光谱显示了氧空位,从而提高了光催化性能。MZT 保持了较高的效率,4 次循环后的损耗小于 20%,这表明它具有在废水处理和减轻环境污染方面反复使用的潜力。研究结果揭示了 MZT 在光催化降解有害有机染料方面的潜力,是一种非常有前途的治理环境污染的解决方案。
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Materials Science and Engineering B-advanced Functional Solid-state Materials
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