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Harnessing barley grains for green synthesis of gold and silver nanoparticles with antibacterial potential. 利用大麦粒绿色合成具有抗菌潜力的金银纳米粒子。
N/A MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2024-06-11 DOI: 10.1186/s11671-024-04042-4
Priyanka Singh, Ivan Mijakovic

The continuous evolution and significance of green resources-based nanomaterials have spurred the exploration of sustainable sources for nanoparticle production. Green synthesis routes offer eco-friendly methodologies, ensuring nanoparticle stability and monodispersity, enhancing their efficiency for various applications. Notably, the thick biological corona layer surrounding nanoparticles (NPs) synthesized through green routes contributes to their unique properties. Consequently, there has been a surge in the development of NPs synthesis methods utilizing medicinal plants and diverse agricultural and waste resources. This study highlights the sustainable potential of barley grains for the synthesis of gold nanoparticles (Barley-AuNPs) and silver nanoparticles (Barley-AgNPs) as an environmentally friendly alternative, followed by NPs characterizations and their application against pathogenic bacteria: Escherichia coli UTI 89 and Pseudomonas aeruginosa PAO1. The rapid synthesis of Barley-AuNPs within 20 min and Barley-AgNPs within 30 min at 90 °C underscores the efficiency of barley as a green precursor. Characterization through advanced techniques, including SEM, TEM, EDS, AFM, DLS, FT-IR, MALDI-TOF, and sp-ICPMS, reveals the 20-25 nm size for Barley-AuNPs, while Barley-AgNPs demonstrate 2-10 nm size with spherical monodispersity. A notable contribution lies in the stability of these NPs over extended periods, attributed to a thick biological corona layer. This corona layer, which enhances stability, also influences the antimicrobial activity of Barley-AgNPs, presenting an intriguing trade-off. The antimicrobial investigations highlight the significant potential of Barley-AgNPs, with distinct minimum bactericidal concentrations (MBC) against P. aeruginosa and E. coli at 8 µg/mL. Overall, this research pioneers the use of barley grains for nanoparticle synthesis and unveils these nanoparticles' unique characteristics and potential antibacterial applications, contributing to the evolving landscape of sustainable nanotechnology.

以绿色资源为基础的纳米材料的不断发展和重要性促使人们探索纳米粒子生产的可持续来源。绿色合成路线提供了生态友好型方法,确保了纳米粒子的稳定性和单分散性,提高了其在各种应用中的效率。值得注意的是,通过绿色合成路线合成的纳米粒子(NPs)周围厚厚的生物电晕层使其具有独特的性能。因此,利用药用植物和各种农业及废弃物资源合成 NPs 的方法得到了迅猛发展。本研究强调了大麦粒合成金纳米粒子(Barley-AuNPs)和银纳米粒子(Barley-AgNPs)作为环境友好型替代品的可持续发展潜力,随后介绍了纳米粒子的特性及其在抗病原菌方面的应用:大肠杆菌 UTI 89 和铜绿假单胞菌 PAO1。大麦-金纳米粒子在 20 分钟内快速合成,大麦-银纳米粒子在 90 °C 下 30 分钟内快速合成,这凸显了大麦作为绿色前体的高效性。通过扫描电子显微镜(SEM)、电子显微镜(TEM)、电致发光分析(EDS)、原子力显微镜(AFM)、激光粒度分析(DLS)、傅立叶变换红外光谱(FT-IR)、MALDI-TOF 和 sp-ICPMS 等先进技术进行表征,发现大麦金纳米粒子的尺寸为 20-25 纳米,而大麦银纳米粒子的尺寸为 2-10 纳米,呈球形单分散性。这些 NPs 的一个显著特点是长期稳定性,这要归功于厚厚的生物电晕层。这种电晕层在提高稳定性的同时,也影响了大麦-AgNPs 的抗菌活性,从而产生了一种耐人寻味的权衡。抗菌研究凸显了大麦-AgNPs 的巨大潜力,其对绿脓杆菌和大肠杆菌的最低杀菌浓度 (MBC) 为 8 µg/mL。总之,这项研究开创了利用大麦粒合成纳米粒子的先河,揭示了这些纳米粒子的独特特性和潜在抗菌应用,为不断发展的可持续纳米技术做出了贡献。
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引用次数: 0
Highly controlled multiplex electrospinning. 高度受控的多重电纺丝。
N/A MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2024-06-06 DOI: 10.1186/s11671-024-04035-3
Isaac C Gilfeather, Harold W Pearson-Nadal, Jessica M Andriolo, Jack L Skinner

Applications of electrospinning (ES) range from fabrication of biomedical devices and tissue regeneration scaffolds to light manipulation and energy conversion, and even to deposition of materials that act as growth platforms for nanoscale catalysis. One major limitation to wide adoption of ES is stochastic fiber deposition resulting from the chaotic motion of the polymer stream as is approaches the deposition surface. In the past, fabrication of structures or materials with precisely determined mesoscale morphology has been accomplished through modification of electrode shape, use of multi-dimensional electrodes or pins, deposition onto weaving looms, hand-held electrospinning devices that allow the user to guide deposition, or electric field manipulation by lensing elements or apertures. In this work, we demonstrate an ES system that contains multiple high voltage power supplies that are independently controlled through a control algorithm implemented in LabVIEW. The end result is what we term "multiplex ES" where multiple independently controlled high-voltage signals are combined by the ES fiber to result in unique deposition control. COMSOL Multiphysics® software was used to model the electric field produced in this novel ES system. Using the multi-power supply system, we demonstrate fabrication of woven fiber materials that do not require complex deposition surfaces. Time-varied sinusoidal wave inputs were used to create electrospun torus shapes. The outer diameter of the tori was found, through parametric analysis, to be rather insensitive to frequency used during deposition, while inner diameter was inversely related to frequency, resulting in overall width of the tori increasing with frequency. Multiplex ES has a high-frequency cutoff based on the time response of the high voltage electrical circuit. These time constants were measured and minimized through the addition of parallel resistors that decreased impedance of the system and improved the high-frequency cutoff by up to 63%.

电纺丝(ES)的应用范围很广,从制造生物医学设备和组织再生支架,到光操纵和能量转换,甚至到沉积作为纳米级催化生长平台的材料。影响 ES 广泛应用的一个主要限制因素是聚合物流在接近沉积表面时的混乱运动所导致的随机纤维沉积。过去,通过改变电极形状、使用多维电极或插针、在织布机上沉积、允许用户引导沉积的手持式电纺丝设备或通过透镜元件或孔径操纵电场,可以制造出具有精确定位的中尺度形态的结构或材料。在这项工作中,我们展示了一个 ES 系统,该系统包含多个高压电源,可通过 LabVIEW 中实施的控制算法进行独立控制。最终结果就是我们所说的 "多路复用 ES",即 ES 光纤将多个独立控制的高压信号组合在一起,从而实现独特的沉积控制。我们使用 COMSOL Multiphysics® 软件对这种新型 ES 系统中产生的电场进行建模。利用多电源系统,我们演示了无需复杂沉积表面的编织纤维材料的制造。时变正弦波输入用于制造电纺丝环形状。通过参数分析发现,环状体的外径对沉积过程中使用的频率并不敏感,而内径则与频率成反比,导致环状体的整体宽度随频率增加而增加。Multiplex ES 具有基于高压电路时间响应的高频截止。通过测量这些时间常数,并通过增加并联电阻器使其最小化,从而降低了系统阻抗,并将高频截止率提高了 63%。
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引用次数: 0
Highly conductive and durable nanocomposite hard coatings of carbon fiber reinforced thermoplastic composites against lightning strikes. 碳纤维增强热塑性复合材料的高导电性和耐久性纳米复合硬涂层可抵御雷击。
N/A MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2024-06-06 DOI: 10.1186/s11671-024-04041-5
Clay Parten, Balakrishnan Subeshan, Ramazan Asmatulu

The growing use of thermoplastic composites (TPCs) like low-melting polyaryletherketone (LM-PAEK) matrices reinforced with unidirectional carbon fiber (CF) in aircraft structures presents a significant challenge in terms of lightning strikes and electromagnetic interference shielding during aircraft operations. This is due to the weak electrical conductivity of TPC structures, which results in widespread damage when struck by lightning. The repair and maintenance of these extended damaged sites can increase operational costs and loss of flights. Several lightning strike protection (LSP) systems have been developed and implemented to address these concerns. This study evaluated a highly conductive coating with a low filler rate for its effectiveness as an LSP solution for TPCs on exterior aircraft surfaces. The TPC panel without any coatings was first studied. Subsequently, the level of conductivity was increased by incorporating the nanoscale conductive fillers, silver-coated copper (Ag/Cu) nanoflakes, with a silver content of 20 wt.% (Ag20/Cu) and 30 wt.% (Ag30/Cu), correspondingly, into the coating at two loadings of 55 wt.% and 70 wt.% in an epoxy carrier for the surface coatings. The behavior of electrical and surface conductivity was thoroughly examined to understand the impact of Ag/Cu with a high aspect ratio and the effectiveness of the LSP solution. In addition, the spray-coated TPC panels underwent rigorous Zone 2A lightning strike testing using simulated lightning current, in agreement with the industry standard of Society of Automotive Engineers (SAE) Aerospace Recommended Practice (ARP) 5412B. Despite the higher resistance due to the lower conductive coating weight, the TPC panels with Ag30/Cu at loading of 70 wt.% achieved better results than those with Ag30/Cu at loading of 55 wt.%. This is evidenced by the minor structural delamination and CF breakage on the front surface, which proposes a new economic route for a sustainable post-processed LSP system in the aviation industry.

在飞机结构中越来越多地使用热塑性复合材料(TPC),如用单向碳纤维(CF)增强的低熔点聚芳醚酮(LM-PAEK)基材,这给飞机运行过程中的雷击和电磁干扰屏蔽带来了巨大挑战。这是由于 TPC 结构的导电性较弱,在遭受雷击时会造成大面积损坏。对这些大面积受损部位进行维修和维护会增加运营成本和航班损失。为了解决这些问题,已经开发并实施了几种雷击防护(LSP)系统。本研究评估了一种低填充率的高导电性涂层作为飞机外表面 TPC 的 LSP 解决方案的有效性。首先研究了没有任何涂层的 TPC 面板。随后,通过在表面涂层的环氧树脂载体中加入银含量分别为 20 wt.%(Ag20/Cu)和 30 wt.%(Ag30/Cu)的纳米级导电填料--银包铜(Ag/Cu)纳米片,提高了涂层的导电性。对导电性和表面导电性的行为进行了深入研究,以了解高纵横比的 Ag/Cu 的影响以及 LSP 溶液的有效性。此外,喷涂的 TPC 面板还接受了严格的 2A 区雷击测试,使用的是模拟雷电流,符合汽车工程师协会(SAE)航空航天推荐实践(ARP)5412B 的行业标准。尽管导电涂层重量较低导致电阻较高,但负载量为 70 wt.% 的 Ag30/Cu TPC 面板比负载量为 55 wt.% 的 Ag30/Cu TPC 面板取得了更好的结果。前表面轻微的结构分层和 CF 断裂证明了这一点,这为航空工业中可持续的后处理 LSP 系统提出了一条新的经济路线。
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引用次数: 0
Mapping the research landscape of nanoparticles and their use in denture base resins: a bibliometric analysis. 绘制纳米粒子及其在义齿基底树脂中的应用的研究图景:文献计量分析。
Pub Date : 2024-05-30 DOI: 10.1186/s11671-024-04037-1
Ravinder S Saini, Shashit Shetty Bavabeedu, Syed Altafuddin Quadri, Vishwanath Gurumurthy, Masroor Ahmed Kanji, Abdulmajeed Okshah, Rayan Ibrahim H Binduhayyim, Mario Alberto Alarcón-Sánchez, Seyed Ali Mosaddad, Artak Heboyan

Background: Nanoparticles are increasingly used in dentistry for various applications, including enhancing the mechanical properties of denture base resins. This study aimed to comprehensively review and analyze the research landscape of nanoparticles and their effect on the flexural strength of denture base resins to identify key research areas and trends and to highlight the importance of collaboration between authors and institutions.

Methods: A Bibliometric Analysis was conducted using the Keywords "Nanoparticle*" AND "Denture*" OR "CAD/CAM." The literature search from the WOS database was restricted to the publication years 2011 to 2022.

Results: Key findings encompass an increase in research publications but a decline in citations. Saudi Arabia, China, and Iraq led this research, with specific institutions excelling. Notable journals with high impact factors were identified. Authorship patterns show variations in citation impact. Additionally, keyword analysis revealed that current research trends offer insights into influential authors and their networks.

Conclusions: The analysis of nanoparticles and denture base resins reveals a dynamic and evolving landscape that emphasizes the importance of collaboration, staying current with research trends, and conducting high-quality research in this ever-evolving domain.

背景:纳米粒子越来越多地应用于牙科领域,包括提高义齿基底树脂的机械性能。本研究旨在全面回顾和分析纳米粒子及其对义齿基底树脂抗弯强度影响的研究概况,以确定关键研究领域和趋势,并强调作者和机构之间合作的重要性:方法:使用关键词 "纳米粒子*"和 "义齿*"进行文献计量分析。和 "义齿*"或 "CAD/CAM"。从 WOS 数据库中搜索的文献仅限于 2011 年至 2022 年出版的文献:主要发现包括研究论文数量增加,但引用次数减少。沙特阿拉伯、中国和伊拉克在这项研究中处于领先地位,其中某些机构表现突出。研究还发现了影响因子较高的著名期刊。作者模式显示了引文影响方面的差异。此外,关键词分析表明,当前的研究趋势有助于深入了解有影响力的作者及其网络:对纳米粒子和义齿基底树脂的分析揭示了一个充满活力、不断发展的领域,强调了合作、紧跟研究趋势以及在这一不断发展的领域开展高质量研究的重要性。
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引用次数: 0
Integrated insulin-iron nanoparticles: a multi-modal approach for receptor-specific bioimaging, reactive oxygen species scavenging, and wound healing. 集成胰岛素-铁纳米粒子:用于受体特异性生物成像、活性氧清除和伤口愈合的多模式方法。
Pub Date : 2024-05-30 DOI: 10.1186/s11671-024-04024-6
Komal Attri, Bhupendra Chudasama, Roop L Mahajan, Diptiman Choudhury

Metallic nanoparticles have emerged as a promising option for various biological applications, owing to their distinct characteristics such as small size, optical properties, and ability to exhibit luminescence. In this study, we have successfully employed a one-pot method to synthesize multifunctional insulin-protected iron [Fe(II)] nanoparticles denoted as [IFe(II)NPs]. The formation of IFe(II)NPs is confirmed by the presence of FTIR bonds at 447.47 and 798.28 cm-1, corresponding to Fe-O and Fe-N bonds, respectively. Detailed analysis of the HR-TEM-EDS-SAED data reveals that the particles are spherical in shape, partially amorphous in nature, and have a diameter of 28.6 ± 5.2 nm. Additionally, Metal Ion Binding (MIB) and Protein Data Bank (PDB) analyses affirm the binding of iron ions to the insulin hexamer. Our findings underscore the potential of IFe(II)NPs as a promising new platform for a variety of biomedical applications due to their high signal-to-noise ratio, and minimal background fluorescence. The particles are highly luminescent, biocompatible, and have a significant quantum yield (0.632). Exemplar applications covered in this paper include insulin receptor recognition and protection against reactive oxygen species (ROS), harmful molecules known to inflict damage on cells and DNA. The IFe(II)NPs effectively mitigate ROS-induced inflammation, which is a hinderance to wound recovery, thereby facilitating enhanced wound recovery.

金属纳米粒子因其小尺寸、光学特性和发光能力等显著特点,已成为各种生物应用的一种有前途的选择。在本研究中,我们采用一锅法成功合成了多功能胰岛素保护铁[Fe(II)]纳米粒子,简称[IFe(II)NPs]。傅立叶变换红外光谱(FTIR)在 447.47 和 798.28 cm-1 处出现了分别对应于 Fe-O 和 Fe-N 键的键,这证实了 IFe(II)NPs 的形成。对 HR-TEM-EDS-SAED 数据的详细分析显示,颗粒呈球形,部分无定形,直径为 28.6 ± 5.2 nm。此外,金属离子结合(MIB)和蛋白质数据库(PDB)分析证实了铁离子与胰岛素六聚体的结合。我们的研究结果表明,IFe(II)NPs 具有高信噪比和最小背景荧光的特点,有望成为多种生物医学应用的新平台。这种粒子具有高发光性、生物相容性和显著的量子产率(0.632)。本文涉及的示例应用包括识别胰岛素受体和抵御活性氧(ROS),众所周知,活性氧是对细胞和 DNA 造成损害的有害分子。IFe(II)NPs 能有效缓解 ROS 引发的炎症(炎症是伤口恢复的障碍),从而促进伤口恢复。
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引用次数: 0
Advancing LED technology: the FDCSP element's breakthrough in mini and micro-LED packaging and backlight module enhancement. 推进 LED 技术:FDCSP 元件在迷你和微型 LED 封装和背光模块增强方面的突破。
Pub Date : 2024-05-28 DOI: 10.1186/s11671-024-04033-5
Jo-Hsiang Chen, Che-Hsuan Huang, Tzu-Yi Lee, Fang-Chung Chen, Tsung-Sheng Kao, Hao-Chung Kuo

In this research, we introduce an advanced methodology for the calculation of bulk light sources tailored for free-form surface design, focusing on the principle of energy conservation. This method is especially relevant for the evolving needs of micro-LED packaging, highlighting its potential in this burgeoning field. Our work includes the development of an algorithm for creating freeform-designed chip-scale package (FDCSP) components. These components seamlessly integrate LEDs and lenses, underscoring our commitment to advancing free-form surface design in chip-level packaging. By adhering to the principle of energy conservation, our approach facilitates a meticulous comparison of simulation outcomes with predefined target functions. This enables the iterative correction of discrepancies, employing layering techniques to refine the design until the simulated results closely align with our goals, as demonstrated by an appropriate difference curve. The practical application of these simulations leads to the innovative design of FDCSP devices. Notably, these devices are not just suitable for traditional applications in backlight modules but are explicitly optimized for the emerging sector of micro-LED packaging. Our successful demonstration of these FDCSP devices within backlight modules represents a significant achievement. It underscores the effectiveness of our design strategy and its expansive potential to transform micro-LED packaging solutions. This research not only contributes to the theoretical understanding of energy conservation in lighting design but also paves the way for groundbreaking applications in micro-LED and backlight module technologies.

在这项研究中,我们介绍了一种先进的方法,用于计算为自由曲面设计量身定制的体光源,重点关注能量守恒原则。这种方法与微型 LED 封装不断发展的需求特别相关,凸显了它在这一新兴领域的潜力。我们的工作包括开发一种用于创建自由形态设计芯片级封装(FDCSP)组件的算法。这些组件无缝集成了 LED 和透镜,彰显了我们在芯片级封装中推进自由形态表面设计的承诺。通过坚持能量守恒原则,我们的方法有助于将模拟结果与预定义的目标函数进行细致比较。这样就能反复修正差异,采用分层技术来完善设计,直到模拟结果与我们的目标密切吻合,正如适当的差异曲线所显示的那样。这些模拟的实际应用促成了 FDCSP 器件的创新设计。值得注意的是,这些器件不仅适用于背光模块的传统应用,还针对微型 LED 封装这一新兴领域进行了明确优化。我们在背光模块中成功演示了这些 FDCSP 器件,这是一项重大成就。它凸显了我们设计策略的有效性及其改变微型 LED 封装解决方案的巨大潜力。这项研究不仅有助于从理论上理解照明设计中的节能问题,还为微型 LED 和背光模块技术的突破性应用铺平了道路。
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引用次数: 0
Green synthesis of silver nanoparticle using pollen extract from Tetragonisca angustula a stingless bee. 利用无刺蜂 Tetragonisca angustula 的花粉提取物绿色合成银纳米粒子。
Pub Date : 2024-05-27 DOI: 10.1186/s11671-024-04038-0
Ana Carolina Costa Santos, Gabriela Carvalho Batista, Rafaela Cavalcante Cerqueira, Mariana Gonçalves Lisboa, Joberth Lee Correa, Tamiris Sabrina Rodrigues, Murillo Néia Thomaz da Silva, Vinícius Prado Bittar, Serena Mares Malta, Natalia Carine Lima Dos Santos, Foued Salmen Espindola, Ana Maria Bonetti, Carlos Ueira-Vieira

This study explores the green synthesis of silver nanoparticles (AgNPs) using a methanolic extract of fermented pollen from Tetragonisca angustula, a species of stingless bees. The AgNPs exhibit spherical morphology, low charge values, and suspension stability, with their unique composition attributed to elements from the pollen extract. Antioxidant assays show comparable activity between the pollen extract and AgNPs, emphasizing the retention of antioxidant effects. The synthesized AgNPs demonstrate antimicrobial activity against multidrug-resistant bacteria, highlighting their potential in combating bacterial resistance. The AgNPs exhibit no toxic effects on Drosophila melanogaster and even enhance the hatching rate of eggs. The study underscores the innovative use of stingless bee pollen extract in green synthesis, offering insights into the varied applications of AgNPs in biomedicine.

本研究探讨了利用一种无刺蜂 Tetragonisca angustula 的发酵花粉甲醇提取物合成银纳米粒子(AgNPs)的绿色方法。银纳米粒子呈现球形形态,电荷值低,悬浮稳定性好,其独特的成分归功于花粉提取物中的元素。抗氧化试验表明,花粉提取物和 AgNPs 的活性相当,这突出表明了其抗氧化效果的保留。合成的 AgNPs 对多种耐药细菌具有抗菌活性,突出了它们在对抗细菌耐药性方面的潜力。AgNPs 对黑腹果蝇无毒性影响,甚至能提高卵的孵化率。这项研究强调了无刺蜂花粉提取物在绿色合成中的创新应用,为 AgNPs 在生物医学中的各种应用提供了启示。
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引用次数: 0
Smart integration of cold plasma stream and surface discharge with ns laser ablation for composite nanomaterial. 冷等离子体流和表面放电与 ns 激光烧蚀的智能集成,用于复合纳米材料。
Pub Date : 2024-05-27 DOI: 10.1186/s11671-024-04034-4
Hafiz Muhammad Akhtar, Muhammad Latif, Mahtab Ahmad Khan, M Abdullah, Taj Muhammad Khan

In this paper, smart integration of cold dielectric barrier discharge (DBD) plasma in various geometrical arrangements with laser ablation at atmospheric pressure for nanomaterial was described. A composite Co:ZnO target was ablated in an airflow by a nanosecond (ns) laser (wavelength: 1064 nm, pulse duration: 30 ns) using fluence of 5 J-cm-2 at a repetition rate of 10 Hz. The nanomaterial produced under vertical and oblique plasma streams, surface discharge and gas flow, were compared. Utilization surface discharge markedly improved the material adhesion by altering surface intrinsic behavior, inducing anticipated surface energy activation, chemical changes, and the formation of a densely packed solid structure. Under all conditions, the material consistently retained its crystalline nature, elemental composition, and ultraviolet emission characteristics. These preliminary findings hold promise for additional research, suggesting avenues for making complex materials in a flexible environment. Such new advancements could facilitate applications in the biomedical, catalysis, pharmaceutical, and surgical device domains.

本文介绍了在常压下将冷介质阻挡放电(DBD)等离子体以不同的几何排列与激光烧蚀智能集成在一起,用于纳米材料的研究。在气流中使用纳秒(ns)激光(波长:1064 nm,脉冲持续时间:30 ns)以 5 J-cm-2 的流量和 10 Hz 的重复频率烧蚀 Co:ZnO 复合靶。比较了在垂直和倾斜等离子体流、表面放电和气流条件下产生的纳米材料。通过改变表面固有行为、诱导预期的表面能量活化、化学变化和形成密集的固体结构,利用表面放电显著提高了材料的附着力。在所有条件下,材料始终保持其结晶性质、元素组成和紫外线发射特性。这些初步发现为进一步研究带来了希望,为在灵活环境中制造复杂材料提供了途径。这些新进展将有助于生物医学、催化、制药和外科手术设备领域的应用。
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引用次数: 0
Multiscale modelling of transport in polymer-based reverse-osmosis/nanofiltration membranes: present and future. 基于聚合物的反渗透/纳滤膜的多尺度传输建模:现状与未来。
Pub Date : 2024-05-21 DOI: 10.1186/s11671-024-04020-w
Haochen Zhu, Anthony Szymczyk, Aziz Ghoufi

Nanofiltration (NF) and reverse osmosis (RO) processes are physical separation technologies used to remove contaminants from liquid streams by employing dense polymer-based membranes with nanometric voids that confine fluids at the nanoscale. At this level, physical properties such as solvent and solute permeabilities are intricately linked to molecular interactions. Initially, numerous studies focused on developing macroscopic transport models to gain insights into separation properties at the nanometer scale. However, continuum-based models have limitations in nanoconfined situations that can be overcome by force field molecular simulations. Continuum-based models heavily rely on bulk properties, often neglecting critical factors like liquid structuring, pore geometry, and molecular/chemical specifics. Molecular/mesoscale simulations, while encompassing these details, often face limitations in time and spatial scales. Therefore, achieving a comprehensive understanding of transport requires a synergistic integration of both approaches through a multiscale approach that effectively combines and merges both scales. This review aims to provide a comprehensive overview of the state-of-the-art in multiscale modeling of transport through NF/RO membranes, spanning from the nanoscale to continuum media.

纳滤(NF)和反渗透(RO)工艺是一种物理分离技术,通过采用具有纳米级空隙的致密聚合物膜,在纳米尺度上限制流体,从而去除液流中的污染物。在这个层面上,溶剂和溶质渗透性等物理特性与分子相互作用有着错综复杂的联系。最初,许多研究都侧重于开发宏观传输模型,以深入了解纳米尺度的分离特性。然而,基于连续体的模型在纳米受限情况下存在局限性,而力场分子模拟可以克服这些局限性。基于连续介质的模型严重依赖于体积特性,往往忽略了液体结构、孔隙几何形状和分子/化学特性等关键因素。分子/中尺度模拟虽然包含这些细节,但往往面临时间和空间尺度的限制。因此,要全面了解传输问题,需要通过多尺度方法将两种方法协同整合,有效结合和融合两种尺度。本综述旨在全面概述通过 NF/RO 膜进行传输的多尺度建模的最新进展,范围从纳米尺度到连续介质。
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引用次数: 0
Analysis of nonlinear bending behavior of nano-switches considering surface effects. 考虑表面效应的纳米开关非线性弯曲行为分析
0 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2024-05-20 DOI: 10.1186/s11671-024-04030-8
Fan Yang, Xuyang Wang, Xianlai Song, Weilin Yang

Nano-switch structures are important control elements in nanoelectromechanical systems and have potential applications in future nanodevices. This paper analyzes the effects of surface effects, geometric nonlinearity, electrostatic forces, and intermolecular forces on the nonlinear bending behavior and adhesion stability of nano-switches. Based on the Von Karman geometric nonlinearity theory, four types of boundary conditions for the nano-switch structure were specifically calculated. The results show that surface effects have a significant impact on the nonlinear bending and adhesion stability of nano-switches. Surface effects increase the adhesion voltage of the nano-switch and decrease its adhesion displacement, and as the size of the nano-switch structure increases, the impact of surface effects decreases. A comparative analysis of the linear theory and the nonlinear theory results shows that the adhesion voltage predicted by the linear theory is smaller than that predicted by the nonlinear theory. The effect of geometric nonlinearity increases as the size of the nano-switch structure increases, as the distance between the electrodes increases, and as the aspect ratio of the nano-switch structure increases. These findings provide theoretical support and reference for the design and use of future nanodevices and nanoelectromechanical systems.

纳米开关结构是纳米机电系统中的重要控制元件,在未来的纳米设备中具有潜在的应用价值。本文分析了表面效应、几何非线性、静电力和分子间力对纳米开关非线性弯曲行为和粘附稳定性的影响。基于 Von Karman 几何非线性理论,具体计算了纳米开关结构的四种边界条件。结果表明,表面效应对纳米开关的非线性弯曲和粘附稳定性有显著影响。随着纳米开关结构尺寸的增大,表面效应的影响减小。对线性理论和非线性理论结果的对比分析表明,线性理论预测的粘附电压小于非线性理论预测的粘附电压。几何非线性的影响随着纳米开关结构尺寸的增大、电极间距的增大以及纳米开关结构纵横比的增大而增大。这些发现为未来纳米器件和纳米机电系统的设计和使用提供了理论支持和参考。
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