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Synergistic adsorption-photocatalysis of In₂S₃/Bi₂₄Fe₂O₃₉ based on oxygen vacancy for efficient tetracycline removal. 基于氧空位的In₂S₃/Bi₂₄Fe₂O₃₉的协同吸附-光催化高效脱除四环素
IF 2.8 4区 材料科学 Q3 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2025-12-30 DOI: 10.1088/1361-6528/ae2c91
Pengfei Su, Keyi Wan, Jiajun Li, Qiuyang Dai, Shijiao Sun, Rongfei Jiang, Jijun Tang, Long Lin, Jiaoxia Zhang

Environmental issues have emerged as a pivotal challenge in the realm of industrial development, rendering the prioritization of renewable energy and sustainable development imperative. Photocatalytic materials should align with these goals by being recyclable and reusable. In this work, spherical nano-Bi₂₄Fe₂O₃₉ was synthesized via a sol-gel method combined with calcination and loaded onto In₂S₃ to construct an S-scheme In₂S₃/Bi₂₄Fe₂O₃₉ heterojunction with superior photocatalytic degradation performance. The composite exhibited an extended light absorption range from 585 nm to 650 nm (IB-30), a narrowed apparent bandgap compared to pure In₂S₃, and significantly improved carrier separation and transfer efficiency. Under the optimal conditions of pH = 7, catalyst dosage = 10 mg, and tetracycline (TC) concentration = 10 mg l-1, the IB-30 material achieved a removal rate of 85.8% for tetracycline, which is 1.7 times and 2.46 times higher than that of pure In₂S₃ and pure Bi₂₄Fe₂O₃₉, respectively. Driven by the built-in electric field, photogenerated electrons follow an S-scheme pathway for transfer, while・O₂-(superoxide anion radicals) and h+(holes) serve as the primary active species, effectively facilitating the photocatalytic degradation reaction. This study provides new insights into developing efficient and stable visible-light-driven photocatalysts.

环境问题已成为工业发展领域的关键挑战,因此必须优先考虑可再生能源和可持续发展。光催化材料应通过可回收和可重复使用来实现这些目标。本文采用溶胶-凝胶法结合煅烧合成了球形纳米Bi₂₄Fe₂O₃₉,并将其加载到In₂S₃上,构建了具有优异光催化降解性能的S-scheme In₂S₃/Bi₂₄Fe₂O₃₉异质结。该复合材料的光吸收范围从585 nm扩展到650 nm (IB-30),并显著提高了载流子分离和转移效率。在pH=7、催化剂用量=10 mg、四环素(TC)浓度=10 mg/L的最佳条件下,IB-30复合材料对四环素的去除率为85.8%,分别是纯In₂S₃和纯Bi₂₄Fe₂O₃₉的1.7倍和2.46倍。在内置电场的驱动下,光生电子遵循S-scheme路径转移,O₂⁻(超氧阴离子自由基)和h⁺(空穴)是主要活性物质,有效促进光催化降解反应。该研究为开发高效、稳定的可见光驱动光催化剂提供了新的思路。
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引用次数: 0
Revolutionizing lithium sulfur batteries: advanced nanocarbon scaffolds for superior sulfur cathodes. 革命性的锂硫电池:先进的纳米碳支架,用于优越的硫阴极。
IF 2.8 4区 材料科学 Q3 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2025-12-30 DOI: 10.1088/1361-6528/ae2e04
Xiao-Fei Yu, Bin Liu, Bin He, Zi-Xin Lin, Juan Xu, Jianyu Cao

Lithium sulfur batteries (LSBs) are regarded as the potential next-generation energy storage system due to their high theoretical energy density and low cost. However, LSBs also face problems such as the dissolution of lithium polysulfide, volume expansion, and the formation of lithium dendrites. Optimizing the design of sulfur cathode materials to tackle these issues at their source is the primary approach to enhancing the performance of LSBs, since the inherent limitations of sulfur are the root cause of the challenges in LSBs. The review covers the latest research on carbon-based sulfur cathode materials of LSBs, including structural design and functional optimization strategies, aiming to prepare multifunctional carbon-based sulfur cathodes by integrating physical confinement, chemical adsorption, and catalytic effect towards lithium polysulfides. The future development directions are prospected, including material design, optimization of reaction mechanisms, and low-cost preparation technologies.

锂硫电池因其理论能量密度高、成本低而被认为是有潜力的下一代储能系统。但LSBs也面临多硫化锂溶解、体积膨胀、锂枝晶形成等问题。优化硫阴极材料的设计,从源头上解决这些问题,是提高硫阴极材料性能的主要方法,因为硫的固有局限性是硫阴极材料面临挑战的根本原因。综述了碳基硫阴极材料在结构设计和功能优化方面的最新研究进展,旨在通过物理约束、化学吸附和对锂多硫化物的催化作用制备多功能碳基硫阴极材料。展望了未来的发展方向,包括材料设计、反应机理优化和低成本制备技术。
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引用次数: 0
Effect of activation temperature on quantum efficiency and lifetime of NEA truncated nanocone array GaAs photocathode. 活化温度对NEA截断纳米锥阵列GaAs光电阴极量子效率和寿命的影响。
IF 2.8 4区 材料科学 Q3 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2025-12-30 DOI: 10.1088/1361-6528/ae2e02
Md Aziz Ar Rahman, Md Abdullah Mamun, Shukui Zhang, Hani E Elsayed-Ali

This study investigates the quantum efficiency (QE) and operational lifetime of a negative electron affinity GaAs truncated nanocone array (TNCA) photocathode benchmarked against a conventional flat GaAs photocathode under varying activation temperatures. The TNCA structure demonstrated a QE of up to 13.6% at 590 nm with room temperature (RT) activation-approximately 1.5 times higher than its flat counterpart. This enhancement is due to Mie resonance effects within the nanostructure, as confirmed by finite-difference time-domain simulations. Moreover, the TNCA photocathode exhibits significantly extended charge lifetime, with enhancement factors of ∼6.1 and ∼19.8 under RT and 50 °C activations, respectively. These gains are primarily attributed to increased effective surface area and optimized dipole layer formation at elevated temperatures. In addition, shorter excitation wavelengths further contribute to lifetime improvements. These findings underscore the TNCA GaAs photocathode's potential as a high QE, long lifetime electron source for many large-scale electron accelerators.

本研究研究了负电子亲和(NEA) GaAs截断纳米锥阵列(TNCA)光电阴极在不同激活温度下的量子效率(QE)和工作寿命,并与传统的扁平GaAs光电阴极进行了对比。TNCA结构在590 nm的室温活化下的QE高达13.6%,大约是其平面结构的1.5倍。这种增强是由于纳米结构内的Mie共振效应,有限差分时域模拟证实了这一点。此外,在室温和50 °C活化下,TNCA光电阴极的充电寿命显著延长,增强因子分别为~6.1和~19.8。这些增益主要归因于在高温下有效表面积的增加和偶极子层形成的优化。此外,较短的激发波长进一步有助于寿命的改善。这些发现强调了TNCA GaAs光电阴极作为许多大型电子加速器的高QE,长寿命电子源的潜力。
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引用次数: 0
Influence of grown conditions on dodecagonal GaN micro-pillars structural parameters investigated by XRD. 用XRD研究了生长条件对十二方GaN微柱结构参数的影响。
IF 2.8 4区 材料科学 Q3 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2025-12-29 DOI: 10.1088/1361-6528/ae2921
J Serafińczuk, P Ciechnowska, S Gorantla, L Pawlaczyk, R Kudrawiec, D Hommel

In this paper, we present results of x-ray diffraction investigations of GaN micro-pillars grown on GaN template. These rods are special in so far that they have stable a- and m-plane side walls and dodecagonal and not hexagonal shape as usual. Such growth mode is simulated by adding As as surfactant. The work shows the influence of changing the amount of gallium and arsenic and lowering the temperature on the growth of micro-pillars. Changing the growth parameters led to both a change in the density of the growing micro-pillars, their height and width, and their structural parameters, such as a disturbance in the direction of growth of the structures. In order to characterize the studied samples, measurements were carried on the configuration from the surface and from the edge of the sample. This measurements method allowed to visualize the structure in the perpendicular and parallel directions of the micro-pillars growth. In addition, the strain and mosaic analysis showed correlations between the resulting shape and density of the rods and the strain of the GaN-pillar and GaNAs crystalline lattice.

本文介绍了在GaN模板上生长GaN微柱的XRD研究结果。这些棒的特殊之处在于,它们有稳定的a面和m面侧壁,而且是十二面而不是通常的六边形。通过添加As作为表面活性剂来模拟这种生长模式。研究了改变镓、砷含量和降低温度对微柱生长的影响。改变生长参数会导致生长微柱的密度、高度和宽度以及结构参数(如结构生长方向的扰动)发生变化。 ;为了对所研究的样品进行表征,从表面和边缘对样品进行了形貌测量。这种测量方法可以将微柱生长的垂直和平行方向上的结构可视化。此外,应变和镶嵌分析还显示了棒状结构的形状和密度与gan柱和gan晶格的应变之间的相关性。
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引用次数: 0
Effect of abrasive morphology on material removal mechanism and surface integrity in SiC precision grinding via molecular dynamics simulations. 基于分子动力学模拟的SiC精密磨削中磨料形貌对材料去除机制和表面完整性的影响
IF 2.8 4区 材料科学 Q3 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2025-12-29 DOI: 10.1088/1361-6528/ae2c90
Xiaoye Wang, Jinghao Yang, Zige Tian, Shuhao Ye, Bokai Li, Zelin Lei, Lingzhi Guo, Jianmin Jiang, Jianbin Jiang

This paper investigates the influence of different abrasive morphology of silicon carbide (SiC) through molecular dynamics simulations on the scratching process, aiming to provide theoretical guidance and process optimization directions for the precision machining of SiC materials. The paper analyzes the differences in contact area, stress distribution, and material deformation mechanisms between sphere, cone, frustum cone, face of a square pyramid and edge of a square pyramid abrasives during the scratching process. It focuses on key characteristics such as scratching force, atom removal, surface topography, amorphous deformation, and subsurface stress distribution. The results show that the morphology of the abrasive significantly affects machining efficiency and surface quality, with sphere abrasives being more prone to plastic deformation and pyramid abrasives tending to cause brittle fracture. Additionally, the interaction between abrasive morphology and SiC crystal orientation also has a significant impact on the scratching process. This paper not only reveals the surface formation mechanisms of SiC under different abrasive morphology but also provides important theoretical and experimental basis for achieving more efficient and precise SiC material machining.

本文通过分子动力学(MD)模拟研究了碳化硅(SiC)不同磨粒形貌对切削过程的影响,旨在为SiC材料的精密加工提供理论指导和工艺优化方向。分析了球、锥、锥锥、方锥面、方锥边磨料在刮擦过程中的接触面积、应力分布和材料变形机理的差异。它侧重于关键特征,如划痕力,原子去除,表面形貌,非晶变形和亚表面应力分布。结果表明:磨料形貌对加工效率和表面质量有显著影响,球形磨料更容易发生塑性变形,锥形磨料更容易发生脆性断裂;此外,磨料形貌和SiC晶体取向之间的相互作用对刮擦过程也有显著影响。本文不仅揭示了不同磨粒形貌下SiC的表面形成机理,而且为实现更高效、更精密的SiC材料加工提供了重要的理论和实验依据。
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引用次数: 0
Microstructural and mechanical properties of spark plasma sintered TiCrC nanocarbide for tools application. 火花等离子烧结TiCrC纳米碳化物的显微组织和力学性能。
IF 2.8 4区 材料科学 Q3 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2025-12-24 DOI: 10.1088/1361-6528/ae2bf5
Mohsen Mhadhbi

In this work, TiCrC nanocarbide was consolidated via spark plasma sintering (SPS) from TiCrC nanopowder prepared via mechanical alloying (MA). The microstructure, elemental compositions, and morphology of the prepared samples were investigated using x-ray diffraction (XRD), scanning electron microscopy coupled with energy dispersive x-ray spectroscopy (SEM/EDX), transmission electron microscopy (TEM) and atomic force microscopy (AFM). The mechanical properties of the sintered (Ti,Cr)C nanocarbide were also studied. XRD studies of the bulk samples show the presence of (Ti,Cr)C and a small amount of Cr3C2and graphite. SEM study reveals the presence of transgranular cleavage in fracture surfaces and the shape of grains is partially rounded. TEM analysis shows that the SPS process leads to the increase in grain size with retention of nanoscale. The optimized SPS parameters were a pressure of 80 MPa, a sintering temperature of 1800 °C and a holding time of 5 min. Results reveal that TiCrC nanocarbide also has an excellent mechanical properties achieving microhardness, relative density, fracture toughness, and compressive strength of 28 GPa, 98.51%, 6.5 MPa m1/2, and 2290 MPa, respectively. Finally, our study shows that the prepared TiCrC nanocarbide can be used for cutting tools without loss of mechanical strength.

以机械合金化法制备的TiCrC纳米粉末为原料,采用火花等离子烧结(SPS)法制备了TiCrC纳米碳化物。采用x射线衍射仪(XRD)、扫描电子显微镜(SEM/EDX)和原子力显微镜(AFM)对制备样品的微观结构、元素组成和形貌进行了研究。研究了烧结后的(Ti,Cr)C纳米碳化物的力学性能。对样品的XRD分析表明,样品中存在(Ti,Cr)C,少量的c3c2和石墨。扫描电镜研究表明,断口表面存在穿晶解理,晶粒形状部分呈圆形。透射电镜分析表明,SPS过程导致晶粒尺寸增大,但保留了纳米尺度。优化后的SPS参数为压力80 MPa,烧结温度1800℃,保温时间5 min。结果表明,TiCrC纳米碳化物具有优异的力学性能,显微硬度、相对密度、断裂韧性和抗压强度分别为28 GPa、98.51%、6.5 MPa•m 1/2和2290 MPa。最后,我们的研究表明,制备的TiCrC纳米碳化物可以在不损失机械强度的情况下用于切削工具。
{"title":"Microstructural and mechanical properties of spark plasma sintered TiCrC nanocarbide for tools application.","authors":"Mohsen Mhadhbi","doi":"10.1088/1361-6528/ae2bf5","DOIUrl":"10.1088/1361-6528/ae2bf5","url":null,"abstract":"<p><p>In this work, TiCrC nanocarbide was consolidated via spark plasma sintering (SPS) from TiCrC nanopowder prepared via mechanical alloying (MA). The microstructure, elemental compositions, and morphology of the prepared samples were investigated using x-ray diffraction (XRD), scanning electron microscopy coupled with energy dispersive x-ray spectroscopy (SEM/EDX), transmission electron microscopy (TEM) and atomic force microscopy (AFM). The mechanical properties of the sintered (Ti,Cr)C nanocarbide were also studied. XRD studies of the bulk samples show the presence of (Ti,Cr)C and a small amount of Cr<sub>3</sub>C<sub>2</sub>and graphite. SEM study reveals the presence of transgranular cleavage in fracture surfaces and the shape of grains is partially rounded. TEM analysis shows that the SPS process leads to the increase in grain size with retention of nanoscale. The optimized SPS parameters were a pressure of 80 MPa, a sintering temperature of 1800 °C and a holding time of 5 min. Results reveal that TiCrC nanocarbide also has an excellent mechanical properties achieving microhardness, relative density, fracture toughness, and compressive strength of 28 GPa, 98.51%, 6.5 MPa m<sup>1/2</sup>, and 2290 MPa, respectively. Finally, our study shows that the prepared TiCrC nanocarbide can be used for cutting tools without loss of mechanical strength.</p>","PeriodicalId":19035,"journal":{"name":"Nanotechnology","volume":" ","pages":""},"PeriodicalIF":2.8,"publicationDate":"2025-12-24","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"145743441","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"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
Hydrothermally synthesized and exfoliated WS2-PEO nanocomposite based non-volatile resistive devices for energy-efficient neuromorphic applications. 基于水热合成和剥离WS2-PEO纳米复合材料的节能神经形态非易失性器件。
IF 2.8 4区 材料科学 Q3 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2025-12-23 DOI: 10.1088/1361-6528/ae291e
Nipom Sekhar Das, Subhankar Das, Franco Mayanglambam, Tanmay Dutta

This work presents a facile, scalable nanocomposite-based resistive memory device incorporating a 2D hybrid of hydrothermally synthesized and exfoliated tungsten disulfide (E-WS2) nanosheets embedded in a poly (ethylene oxide) (PEO) matrix for energy efficient neuromorphic applications. WS2was synthesized via a simple, cost-effective hydrothermal method and subsequently exfoliated via liquid phase exfoliation to obtain few-layer nanosheets with improved surface uniformity and reduced defect density. These nanosheets were integrated into the active layer of an ITO/E-WS₂+ PEO/Cu device fabricated via spin coating and thermal evaporation. The device exhibits reliable bipolar resistive switching with low SET voltages, a high ON/OFF current ratio (∼10⁴), excellent retention (>450 s), and endurance over 70 cycles. The transport mechanism is governed by Ohmic conduction at low voltages, followed by space charge limited current (SCLC) and trap-controlled SCLC (TC-SCLC) mechanisms near-threshold voltages. Energy band analysis indicates that charge trapping and de-trapping at the WS2/PEO interface plays a critical role in the switching process. Compared to bulk WS2, exfoliated WS2offers enhanced interfacial contact, lower resistance pathways, and reduced variability in switching, resulting in improved device performance and stability. It also shows more analog like behavior. Sulfur vacancies in E-WS₂ assist in forming conductive filaments, while the PEO matrix enhances ionic mobility and switching behavior. This work offers a scalable, environmentally benign approach to fabricating 2D material-based resistive memory, establishing solution-processed E-WS₂ nanocomposites as strong candidates for next-generation, scalable, energy-efficient non-volatile memory and neuromorphic technologies.

这项工作提出了一种简单、可扩展的基于纳米复合材料的电阻性存储器件,该器件将水热合成和剥离的二硫化钨(E-WS2)纳米片嵌入聚环氧乙烷(PEO)基体中,用于节能神经形态应用。采用简单、经济的水热法合成WS2,然后通过液相剥离(LPE)获得具有改善表面均匀性和降低缺陷密度的少层纳米片。将这些纳米片集成到通过自旋涂层和热蒸发制备的ITO/E-WS₂+PEO/Cu器件的活性层中。该器件具有可靠的双极电阻开关,具有低SET电压、高开/关电流比(~10⁴)、优异的保持力(>450 s)和超过70个周期的耐用性。在低电压下,传输机制由欧姆传导控制,其次是空间电荷限制电流(SCLC)和阈值电压附近的陷阱控制SCLC (TC-SCLC)机制。能带分析表明,WS2/PEO界面的电荷捕获和释放在开关过程中起着关键作用。与散装WS2相比,剥离的WS2提供了增强的界面接触,更低的电阻路径,减少了开关的可变性,从而提高了器件的性能和稳定性。它还显示出更多类似模拟的行为。E-WS 2中的硫空位有助于形成导电细丝,而PEO基质增强了离子迁移率和开关行为。这项工作提供了一种可扩展的、环保的方法来制造基于二维材料的电阻式存储器,建立了溶液处理的E-WS₂纳米复合材料作为下一代、可扩展的、节能的非易失性存储器和神经形态技术的强有力的候选材料。
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引用次数: 0
The impact of morphological structure and flexo-chemical strains on the electric transport mechanisms in the molybdenum-disulfide-oxide nanoflakes. 形态结构和柔化应变对二硫化钼纳米片电输运机制的影响。
IF 2.8 4区 材料科学 Q3 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2025-12-23 DOI: 10.1088/1361-6528/ae308e
Alexander Pylypchuk, Victor V Vainberg, V Poroshin, Anastasia Volodymyrivna Terebilenko, Andrii Nikolenko, V Popenko, A Tolochko, M Olenchuk, O Bezkrovnyi, G Dovbeshko, Tomash Sabov, B Romanyuk, S Kolotilov, Anna N Morozovska

Electric conduction mechanisms in the pressed powder samples consisting of the molybdenum-disulfide-oxide (MoSxOy) nanoflakes depending on their content and structure have been investigated. The MoSxOy nanoflakes were synthesized in the temperatures range of 130 to 180oC by reaction of (NH4)6Mo7O24 with thiourea in aqueous solution followed by aerial oxidation. The chemical composition and structure of the powders have been determined by means of XPS, EDS and Raman spectroscopy. The obtained nanoflakes are 10-20 nm thick and self-assembled in the "nanoflower"-shape agglomerates forming powder particles. The agglomerates in powders synthesized at different temperatures are shown to consist of MoS2 and molybdenum oxides/sulfoxides which content ratio differs from each other in powders depending on their synthesis temperature. The current vs voltage (I-V) dependences of the pressed powder films manifest a hysteresis-like behavior with substantial dependence on this ratio. For the samples with the highest content of the Mo oxide/sulfoxide nanoflake forms (>50 %) one observes the negative differential conductivity (NDC) in the I-V characteristics and very large difference between the forward and backward I-V branches at small DC biases. Unlike, the samples with low content of these forms have slightly non-linear I-V characteristics, narrower hysteresis loop and absence of NDC. All samples manifest long-lasting (tens second) transient charge/discharge process after switching "on/off" the voltage across the sample, and ability of large charge accumulation with the specific capacitance equal achieving 12-75 F/g depending on the powder synthesis temperature. These phenomena give evidence of the important role of interface charges in the MoSxOy powder electric conduction mechanisms. To describe theoretically the observed I-V curves, polar and electric-transport properties of the pressed MoSxOy nanoflake films, the Landau-Cahn-Hilliard approach considering flexo-chemical field has been used. The revealed features of electric conduction and charge accumulation look interesting for possible applications in nanoelectronics and charge storage devices.

本文研究了由二硫化钼-氧化物(MoSxOy)纳米片组成的压制粉末样品中不同含量和结构的导电机理。采用(NH4)6Mo7O24与硫脲在130 ~ 180℃的水溶液中反应,并进行空气氧化法制备了MoSxOy纳米片。用XPS、EDS和拉曼光谱对粉末的化学成分和结构进行了表征。所制得的纳米薄片厚度为10 ~ 20nm,并以“纳米花”状团聚体自组装形成粉末颗粒。在不同温度下合成的粉末中的团聚体由二硫化钼和钼氧化物/亚砜组成,它们在粉末中的含量比例因合成温度的不同而不同。压下的粉末薄膜的电流与电压(I-V)依赖性表现出类似迟滞的行为,与该比率有很大的依赖性。对于氧化钼/亚砜纳米薄片形式含量最高的样品(bbb50 %),可以观察到I-V特性的负差分电导率(NDC),并且在小直流偏置下,正向和反向I-V支路之间的差异非常大。与低含量的样品不同,这些形态的样品具有轻微的非线性I-V特性,滞回线更窄,不存在NDC。所有样品在打开/关闭样品上的电压后都表现出持久(数十秒)的瞬态充电/放电过程,并且根据粉末合成温度的不同,具有比电容相等的大电荷积累能力,达到12-75 F/g。这些现象证明了界面电荷在MoSxOy粉末导电机制中的重要作用。为了从理论上描述所观察到的MoSxOy纳米片薄膜的I-V曲线、极性和电输运性质,采用了考虑柔化场的Landau-Cahn-Hilliard方法。揭示的导电和电荷积累的特征对于纳米电子学和电荷存储器件的可能应用很有趣。
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引用次数: 0
DFT coupled with NEGF study of N-type MOSFET based on 2D Bi2C3semiconductor. 基于二维bi2c3半导体的n型MOSFET的DFT耦合NEGF研究。
IF 2.8 4区 材料科学 Q3 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2025-12-23 DOI: 10.1088/1361-6528/ae2922
Yongjun Huang, Jialin Yang, Weicong Sun, Hengze Qu, Chuyao Chen, Huipu Wang, Jia Dong, Xiaoqin Shi, Shengli Zhang

As silicon-based FETs face scaling limits, two-dimensional (2D) material emerge as promising alternatives with potential to suppress short-channel effects and reduce power consumption. We present a comprehensive investigation of the novel 2D bismuth carbide (Bi2C3) semiconductor using first-principles density functional theory (DFT) calculations combined with non-equilibrium green's function (NEGF) quantum transport simulations. Electronic band structure calculations indicate that monolayer Bi2C3possesses a moderate direct bandgap, a sharp conduction band, and a low electron effective mass (0.48m0). Device simulations reveal outstanding performance: a Bi2C3FET with a 10 nm channel length achieves an ultra-high on-state current (Ion) of 2540μAμm-1while maintaining a high on/off current ratio (exceeding 104), satisfying the requirements of the international technology roadmap for semiconductors (ITRS) for high-performance (HP) applications. Furthermore, scaling the channel length down to 5 nm still yields device performance compliant with ITRS specifications. Crucially, devices across different channel lengths exhibit fast switching speeds, low power-delay (τ), power-delay product, and excellent energy-delay product, fully meeting the ITRS HP targets. This study, for the first time, systematically evaluates the application potential of Bi2C3in MOSFETs via DFT-NEGF. Its excellent comprehensive performance metrics demonstrate that monolayer Bi2C3is a highly competitive candidate channel material for future HP integrated circuits.

由于硅基fet面临缩放限制,2D材料成为有希望的替代品,具有抑制短通道效应和降低功耗的潜力。我们利用第一性原理密度泛函理论(DFT)计算结合非平衡格林函数(NEGF)量子输运模拟,对新型二维碳化铋(Bi2C3)半导体进行了全面的研究。电子能带结构计算表明,单层Bi2C3具有中等的直接带隙、锐利的导带和较低的电子有效质量(0.48 m0)。器件仿真显示了优异的性能:10nm通道长度的Bi2C3 FET可实现2540 μA/μm的超高导通电流(Ion),同时保持高通断电流比(超过104),满足国际半导体技术路线图(ITRS)对高性能(HP)应用的要求。此外,将通道长度缩小到5nm仍然可以产生符合ITRS规范的器件性能。关键是,不同通道长度的器件表现出快速的开关速度、低功率延迟(τ)、功率延迟积(PDP)和优异的能量延迟积(EDP),完全满足ITRS HP目标。本研究首次通过DFT-NEGF系统评价了Bi2C3在mosfet中的应用潜力。其优异的综合性能指标表明,单层Bi2C3是未来惠普集成电路极具竞争力的候选通道材料。
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引用次数: 0
Fabrication of PbS/CdS/TiO2nanotube array for enhanced photoelectrochemical response and photocathodic protection performance. PbS/CdS/TiO2纳米管阵列的制备及其光电响应和光电阴极保护性能。
IF 2.8 4区 材料科学 Q3 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2025-12-22 DOI: 10.1088/1361-6528/ae2c04
Chong Peng, Yun Gao, Rongjie Gao, Zihao Qiao

A ternary stepped heterojunction of PbS/CdS/TiO2was fabricated using the successive ionic layer adsorption and reaction method, which significantly enhanced the photocathodic protection performance of TiO2. The experimental results demonstrate the superiority of the dual-loading modification over its single-loading counterparts. The co-loading of CdS and PbS resulted in a TiO2nanocomposite with a reduced bandgap of 1.0 eV, a further extended light absorption range, and enhanced visible light utilization efficiency. The PbS/CdS/TiO2electrode exhibited a photogenerated current density of 6.46 mA cm-2, which is 1.6 times and 22.1 times higher than that of PbS/TiO2and pure TiO2, respectively. The dual loading of metal sulfide semiconductors markedly improved the photoelectrochemical properties of TiO2and its corresponding photocathodic protection effect.

通过连续离子层吸附反应(SILAR)制备了三元阶梯异质结PbS/CdS/TiO2,显著提高了TiO2的光电阴极 ;保护性能。实验结果表明,双加载改性优于单加载改性。共载cd和PbS,使TiO2纳米复合材料的带隙宽度减小到1.0 eV,进一步扩大了光吸收范围,提高了可见光利用效率。PbS/CdS/TiO2电极的光生电流密度分别为6.46 mA·cm-2和 ,分别是PbS/TiO2和TiO2的1.6倍和22.1倍。双负载金属硫化物半导体显著改善了TiO2的光电化学性能及其光电阴极保护效果。
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