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Coupled Piezocatalysis and Photocatalysis in Melt-Quenched Bi2VO5.5 for Dye Degradation 熔融淬灭Bi2VO5.5的耦合压电催化和光催化降解染料
IF 2.5 4区 工程技术 Q3 ENGINEERING, ELECTRICAL & ELECTRONIC Pub Date : 2025-10-19 DOI: 10.1007/s11664-025-12419-z
Manish Kumar, Akshay Gaur, Abhishek Shukla, Sobhy M. Ibrahim, Rahul Vaish, Anuruddh Kumar

This study highlights the coupling of photocatalytic and piezocatalytic activity, potentially improving the efficacy of synthesis under both solar and visible light conditions. The melt-quench technique was employed to synthesize a single-phase Bi2VO5.5 (BV) sample. The orthorhombic Bi2VO5.5 phase was established using Raman spectroscopy and x-ray diffraction. Analysis via scanning electron microscopy demonstrated the irregular morphology of the synthesized Bi2VO5.5. X-ray photoelectron spectroscopy revealed the different elemental oxidation states that were present. During the synergetic piezo-photocatalysis experiment under visible light in methylene blue dye, degradation efficiency of (sim )63% within 180 min was achieved. The kinetic rate constant was investigated in relation to the concentration of the dye. The kinetic rate constants for the BV sample under sunlight were 0.01168 min−1 and 0.02183 min−1 for photocatalysis in 90 min and piezo-photocatalysis in 30 min, respectively.

这项研究强调了光催化和压电催化活性的耦合,潜在地提高了在太阳能和可见光条件下的合成效率。采用熔体淬火技术合成了单相Bi2VO5.5 (BV)样品。利用拉曼光谱和x射线衍射确定了正交Bi2VO5.5相。扫描电镜分析表明合成的Bi2VO5.5形貌不规则。x射线光电子能谱揭示了存在的不同元素氧化态。在可见光下亚甲基蓝染料的协同压电光催化实验中,降解效率为(sim ) 63% within 180 min was achieved. The kinetic rate constant was investigated in relation to the concentration of the dye. The kinetic rate constants for the BV sample under sunlight were 0.01168 min−1 and 0.02183 min−1 for photocatalysis in 90 min and piezo-photocatalysis in 30 min, respectively.
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引用次数: 0
Sustainable Engineering of FAPbI3 Perovskite Solar Cells via Green Solvent Processing and Fluorinated Interfacial Passivation 绿色溶剂工艺和氟化界面钝化制备FAPbI3钙钛矿太阳能电池的可持续工程研究
IF 2.5 4区 工程技术 Q3 ENGINEERING, ELECTRICAL & ELECTRONIC Pub Date : 2025-10-18 DOI: 10.1007/s11664-025-12462-w
Abhishek Kumar Chauhan, Avinash Vishwakarma, Ramashanker Gupta, Swapnil Barthwal

We report a sustainable and efficient route for the fabrication of formamidinium lead iodide (FAPbI3) perovskite solar cells (PSCs) via a green solvent-based two-step deposition process. In this method, PbI2 is dissolved in dimethyl sulfoxide (DMSO), a less toxic solvent than traditional dimethylformamide (DMF), and spin-coated, followed by the deposition of FAI from isopropanol (IPA). Furthermore, surface passivation using a fluorinated interlayer, 4F-phenethylammonium iodide (PEAI), improves device morphology and charge transport, resulting in a power conversion efficiency (PCE) of 19.61.%. Comprehensive structural, optical, and electrical characterizations confirm enhanced crystallinity, reduced trap density, and suppressed hysteresis in treated devices. This environmentally benign and industrially scalable process paves the way for the commercialization of high-performance, low-toxicity perovskite photovoltaics.

Graphical abstract

我们报道了一种可持续和高效的途径,通过绿色溶剂基两步沉积工艺制备了碘化甲醛铅(FAPbI3)钙钛矿太阳能电池(PSCs)。在这种方法中,PbI2溶解在二甲亚砜(DMSO)中,这是一种比传统的二甲甲酰胺(DMF)毒性更小的溶剂,并自旋涂覆,然后由异丙醇(IPA)沉积FAI。此外,使用氟化中间层4f -苯乙基碘化铵(PEAI)进行表面钝化,改善了器件形态和电荷输运,使功率转换效率(PCE)达到19.61%。全面的结构、光学和电学表征证实了处理后器件的结晶度增强、陷阱密度降低和迟滞抑制。这种环保且工业化可扩展的工艺为高性能、低毒性钙钛矿光伏电池的商业化铺平了道路。图形抽象
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引用次数: 0
Dissociation Energy Calculations of Multivacancies in Monolayer Gallium Nitride 单层氮化镓中多空位的解离能计算
IF 2.5 4区 工程技术 Q3 ENGINEERING, ELECTRICAL & ELECTRONIC Pub Date : 2025-10-17 DOI: 10.1007/s11664-025-12457-7
Asih Melati, Nurul Fajariah, Dian Putri Hastuti, Sholihun Sholihun

The structural stability of multivacancies in monolayer gallium nitride has been studied using density functional theory (DFT) with the generalized gradient approximation (GGA) of Perdew–Burke–Ernzerhof for the exchange–correlation functional. The supercell consisting of 72 atomic sites is used to model the multivacancies, with all atoms in the supercell relaxed during optimization. The multivacancies are created by removing a pair of Ga–N atoms sequentially from the center of the supercell, following the part-of-hexagonal-ring method. The multivacancies modeled are monovacancy to hexadecavacancy. The stability of multivacancies is analyzed through the formation and dissociation energies. From the calculated energies, we conclude that hexa- and decavacancies are stable multivacancies, indicating that multivacancies in monolayer GaN tend to agglomerate to hexa- and decavacancies. To show the effect of atomic relaxation, we compare our DFT results with the dangling bond counting model, which ignores atomic relaxation. The symmetry of each defective system is discussed.

Graphical Abstract

利用密度泛函理论(DFT)和Perdew-Burke-Ernzerhof交换相关泛函的广义梯度近似(GGA),研究了单层氮化镓中多空位的结构稳定性。采用由72个原子位组成的超级单体来模拟多空位,在优化过程中,超级单体中的所有原子都是松弛的。根据部分六边形环法,从超级单体中心依次移除一对Ga-N原子,从而产生多空位。多空位模型从单空位到十六进制空位。通过形成能和离解能分析了多空位的稳定性。从计算得到的能量来看,六空位和十空位是稳定的多空位,表明单层氮化镓中的多空位倾向于聚集成六空位和十空位。为了显示原子弛豫的影响,我们将DFT结果与忽略原子弛豫的悬空键计数模型进行了比较。讨论了各缺陷系统的对称性。图形抽象
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引用次数: 0
Comparative Study of Thermoelectric Behavior in NiO Thin Films Deposited at Varying Pressures 不同压力下NiO薄膜热电行为的比较研究
IF 2.5 4区 工程技术 Q3 ENGINEERING, ELECTRICAL & ELECTRONIC Pub Date : 2025-10-17 DOI: 10.1007/s11664-025-12453-x
Satyendra Pratap Singh, S. Gaurav, Venkatesh Mishra, Vishal Singh Chandel

Nickel oxide and aluminum-doped zinc oxide thin films were successfully deposited using pulsed laser deposition. Two nickel oxide thin films were grown at deposition pressure of 10 mTorr (≈ 1.33 Pa) and 20 mTorr (≈ 2.66 Pa). The prepared NiO thin film was successfully characterized using x-ray diffraction, ultraviolet (UV) spectroscopy, and Hall measurement techniques. The thermoelectric measurements were carried out using an in-house-developed thermoelectric setup. The Seebeck coefficient values for the nickel oxide thin films prepared at 20 mTorr and 10 mTorr were found to be nearly the same, at approximately 0.018 mV/K. The power factors at 20 mTorr and 10 mTorr for the nickel oxide thin films were estimated to be 0.00008424 mW cm−1 K−2 and 0.0000312 mW cm−1 K−2, and the figure of merit was estimated as 0.125 and 0.046, respectively.

Graphical abstract

利用脉冲激光沉积技术成功制备了氧化镍和掺铝氧化锌薄膜。在10 mTorr(≈1.33 Pa)和20 mTorr(≈2.66 Pa)的沉积压力下生长了两层氧化镍薄膜。利用x射线衍射、紫外光谱和霍尔测量技术对制备的NiO薄膜进行了表征。热电测量使用内部开发的热电装置进行。在20 mTorr和10 mTorr下制备的氧化镍薄膜的塞贝克系数值几乎相同,约为0.018 mV/K。在20 mTorr和10 mTorr下,氧化镍薄膜的功率因数分别为0.00008424 mW cm−1 K−2和0.0000312 mW cm−1 K−2,其优值分别为0.125和0.046。图形抽象
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引用次数: 0
Features of Synthesis of Niobates in Conditions of Low-temperature Underwater Plasma 低温水下等离子体条件下铌酸盐合成的特点
IF 2.5 4区 工程技术 Q3 ENGINEERING, ELECTRICAL & ELECTRONIC Pub Date : 2025-10-15 DOI: 10.1007/s11664-025-12471-9
Anna Khlyustova, Nikolay Sirotkin, Anton Kraev, Alexander Agafonov

Chromium niobate (CrNbO4), molybdenum niobate (Mo3Nb2O14), titanium niobate (TiNb2O7), and binary oxide based on Nb2O5 and WO3 were synthesized by low-temperature underwater plasma. The electrode materials (Nb, Mo, Cr, Ti, and W) were used as precursors. X-ray powder diffraction (XRD), scanning electron microscopy (SEM), thermogravimetric (TG) analysis, and impedance analysis were used to characterize the obtained materials. The results of XRD showed that in the case of combining electrodes from niobium and molybdenum and chromium and titanium, niobates are formed, and in the niobium-tungsten pair, a mixture of oxides is formed. The results of dielectric measurements showed that the obtained materials have high dielectric constants (εr > 10–60 at f > 1 kHz). Thermal analysis data allowed us to propose a mechanism for the formation of niobates in underwater plasma conditions.

采用低温水下等离子体法制备了铌酸铬(CrNbO4)、铌酸钼(Mo3Nb2O14)、铌酸钛(TiNb2O7)和基于Nb2O5和WO3的二元氧化物。电极材料(Nb, Mo, Cr, Ti, W)作为前驱体。采用x射线粉末衍射(XRD)、扫描电镜(SEM)、热重分析(TG)和阻抗分析等方法对所得材料进行表征。XRD结果表明,在铌钼和铬钛结合电极的情况下,形成铌酸盐,在铌钨对中形成氧化物混合物。介电测量结果表明,所得材料具有较高的介电常数(εr > 10 ~ 60,在f >; 1 kHz)。热分析数据使我们提出了在水下等离子体条件下形成铌酸盐的机制。
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引用次数: 0
Morphology Tunability to Large-Scale Cross-linked Vertically Grown MoS2 Nanopetals Using Ambient Pressure Chemical Vapor Deposition for NO2 Sensing 环境压力化学气相沉积用于NO2传感的大规模交联垂直生长MoS2纳米金属的形貌可调性
IF 2.5 4区 工程技术 Q3 ENGINEERING, ELECTRICAL & ELECTRONIC Pub Date : 2025-10-15 DOI: 10.1007/s11664-025-12454-w
Shreerupa Biswas, Sapana Ranwa

The growth of large-area, continuous, and crystalline vertically grown MoS2 nanostructures is always highly challenging. Morphological tuning of atmospheric pressure chemical vapor deposition (APCVD)-grown MoS2 nanostructures can be achieved via precise control over deposition parameters, demonstrating engineered properties suitable for gas sensing applications. In the present work, a one-step APCVD growth procedure is developed for optimized morphological evolution, which allows the synthesis of large-scale cross-linked vertically grown MoS2 nanopetal structures with high crystallinity and phase selectivity. The optimized morphological tuning enabled the transformation from MoO2/MoS2 nanoplates into hybrid MoO2/MoS2 nanostructures, leading to the growth of V-MoS2 nanopetals over a SiO2/Si substrate by controlling sulfur concentration with the help of sulfur precursor temperature and Ar gas flow. Field-emission scanning electron microscopy (FESEM) clearly shows the evolution of the morphology in APCVD growth. Raman spectra and x-ray diffraction clearly support the synthesis of vertically grown cross-linked MoS2 nanopetals and structural and phase transformation from MoO2/MoS2 nanoplates to V-MoS2 nanopetals. Current–voltage (IV) characteristics demonstrate an increase in current conduction as the morphology changes from MoO2/MoS2 nanoplates to V-MoS2 nanopetals and shows ohmic behavior. The edge-enriched V-MoS2 nanopetals demonstrate the highest sensitivity of 61.78% for 100 ppm NO2 at 100°C operating temperature. The relative response of the V-MoS2 nanopetal sensor increases from 16.93% to 61.78% as the gas concentrations of NO2 increases from 1 ppm to 100 ppm at 100°C operating temperature. This optimized nanosensor demonstrates the highest selectivity towards NO2 gas, with a limit of detection (LOD) of 1 ppm and a fast response of 22 s.

大面积、连续、晶体垂直生长的二硫化钼纳米结构的生长一直是极具挑战性的。通过精确控制沉积参数,可以实现常压化学气相沉积(APCVD)生长的二硫化钼纳米结构的形态调谐,从而展示出适合气敏应用的工程特性。在本工作中,为了优化形态进化,开发了一步APCVD生长工艺,从而可以合成具有高结晶度和相选择性的大规模交联垂直生长的二硫化钼纳米结构。优化后的形态调整使MoO2/MoS2纳米片转变为混合MoO2/MoS2纳米结构,并通过硫前驱体温度和Ar气体流量控制硫浓度,从而在SiO2/Si衬底上生长V-MoS2纳米金属。场发射扫描电镜(FESEM)清晰地显示了APCVD生长过程中形貌的演变。拉曼光谱和x射线衍射清楚地支持垂直生长交联MoS2纳米金属的合成以及从MoO2/MoS2纳米板到V-MoS2纳米金属的结构和相转变。电流-电压(I-V)特性表明,当形貌从MoO2/MoS2纳米板转变为V-MoS2纳米金属时,电流传导增加,并表现出欧姆行为。在100°C的工作温度下,富边V-MoS2纳米金属对100 ppm NO2的灵敏度最高,为61.78%。在100℃工作温度下,当NO2气体浓度从1 ppm增加到100 ppm时,V-MoS2纳米金属传感器的相对响应从16.93%增加到61.78%。优化后的纳米传感器对NO2气体具有最高的选择性,检测限(LOD)为1 ppm,快速响应时间为22 s。
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引用次数: 0
Doping on Lizardite/Graphene Vertically Stacked Heterostructures: A DFT Study lilizardite /石墨烯垂直堆叠异质结构的掺杂:DFT研究
IF 2.5 4区 工程技术 Q3 ENGINEERING, ELECTRICAL & ELECTRONIC Pub Date : 2025-10-15 DOI: 10.1007/s11664-025-12460-y
Angsula Ghosh, Consuelo Alves da Frota, Cícero Augusto Mota Cavalcante, Hidembergue Ordozgoith da Frota

A comprehensive study of the capability for graphene doping in a lizardite/graphene heterostructure has been conducted. Formation energy calculations of the 12 heterostructures exhibit the chemical stability of all the conformations. The electronic properties of doped lizardite/graphene heterostructures preserve the electronic characteristics of graphene while inducing a p-type/n-type doping due to the substitutional impurity of lizardite. The modified electronic properties of the heterostructures resulting from doping have been thoroughly examined. Moreover, the enhanced conductivity of the heterostructures confirms the doping of graphene and widens the scope of the applicability of graphene.

对石墨烯在蜥蜴石/石墨烯异质结构中的掺杂性能进行了全面的研究。12种异质结构的形成能计算显示了所有构象的化学稳定性。掺杂的蜥蜴石/石墨烯异质结构的电子性质保留了石墨烯的电子特性,但由于蜥蜴石的取代杂质诱导了p型/n型掺杂。对掺杂引起的异质结构的电子性质进行了全面的研究。此外,异质结构电导率的增强证实了石墨烯的掺杂,拓宽了石墨烯的适用范围。
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引用次数: 0
Study on the Mechanism of Stress Derivation in Laser Cladding WC60 Assisted by Alternating Magnetic Field 交变磁场辅助下WC60激光熔覆应力衍生机理研究
IF 2.5 4区 工程技术 Q3 ENGINEERING, ELECTRICAL & ELECTRONIC Pub Date : 2025-10-14 DOI: 10.1007/s11664-025-12427-z
Chang Li, Qian Sun, Ruijun Wang, Yiqi Wang, Xing Han

Tungsten carbide (WC) is an alloy powder with excellent performance. However, there are significant technical bottlenecks in the high-content WC composite cladding process. Owing to the density difference between the WC hard phase and the metal matrix, WC particles tend to deposit and cluster during the cladding process, forming a concentrated zone at the bottom of the coating. This can induce cracks, pores, and other defects, resulting in uneven performance of the cladding layer and reducing the service life of the workpiece by 40–50%. Research indicates that the alternating magnetic field-assisted process generates Lorentz forces to implement electromagnetic stirring, thereby achieving a more uniform distribution of WC particles. This process enhances heat and mass transfer efficiency and promotes grain refinement. In this paper, a numerical model of the laser cladding process of 42CrMo with nickel-based WC60 composite powder was established. The influence of stress-fatigue laws on the cladding process under no magnetic field and with magnetic fields of 20 mT, 40 mT, and 60 mT was calculated respectively. Scanning electron microscope (SEM), x-ray diffraction (XRD), and microhardness observations were conducted to examine the microstructure morphology, phase composition, and hardness of the cladding layer. Based on the test results, an internal model of the cladding layer was established, and the derived distribution of internal stress was calculated. Calculations show that alternating magnetic fields significantly affect the sedimentation and stress distribution of WC particles. The stronger the field, the more WC particles float. The smaller the stress derived, the higher the hardness.

碳化钨(WC)是一种性能优良的合金粉末。然而,高含量WC复合熔覆工艺存在着明显的技术瓶颈。由于WC硬相与金属基体之间存在密度差,在熔覆过程中WC颗粒容易沉积、聚集,在熔覆层底部形成集中区。这会诱发裂纹、气孔和其他缺陷,导致熔覆层性能不均匀,使工件的使用寿命降低40-50%。研究表明,交变磁场辅助过程产生洛伦兹力实现电磁搅拌,从而使WC颗粒分布更加均匀。这一过程提高了传热传质效率,促进了晶粒细化。本文建立了42CrMo与镍基WC60复合粉末激光熔覆过程的数值模型。分别计算了无磁场、20 mT、40 mT和60 mT磁场下应力-疲劳规律对熔覆过程的影响。采用扫描电镜(SEM)、x射线衍射(XRD)和显微硬度观察对熔覆层的显微组织形貌、相组成和硬度进行了检测。基于试验结果,建立了熔覆层内部模型,并对其内应力分布进行了计算。计算表明,交变磁场对WC颗粒的沉降和应力分布有显著影响。磁场越强,WC粒子漂浮的越多。导出的应力越小,硬度越高。
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引用次数: 0
Study of TiO2 as a Nucleation Site and the Effect of Growth Time on the Morphology of ZnO/TiO2 Nanostructures, Evolving from Nanorods to Nanofibers TiO2作为成核位点的研究及生长时间对ZnO/TiO2纳米结构形态的影响——从纳米棒到纳米纤维的演变
IF 2.5 4区 工程技术 Q3 ENGINEERING, ELECTRICAL & ELECTRONIC Pub Date : 2025-10-13 DOI: 10.1007/s11664-025-12447-9
E. León-Salguero, J. Alvarado-Rivera, D. Berman-Mendoza, R. Gómez-Fuentes

Zinc oxide (ZnO) nanostructures, from nanorods to nanofibers, were synthesized using a straightforward hydrothermal method. Samples were synthesized with different growth times of 5 h, 12 h, and 20 h, as well as different titanium dioxide (TiO2) atomic percentages (0, 3, and 6 at%). Characterization was performed by scanning electron microscopy (SEM) for morphological study, while chemical composition was analyzed using x-ray photoelectron spectroscopy (XPS) and x-ray energy dispersive spectroscopy (EDS). Optical properties were measured by Raman spectroscopy at room temperature. The formation of ZnO nanorods and nanowires was confirmed trough SEM and the chemical composition by EDS and XPS. In this work, we propose a controlled growth mechanism of ZnO nanorods using TiO2 as nucleation centers without affecting the lattice parameters or doping. SEM images reveal a physical effect on nanostructure growth due to the influence of TiO2 nanoparticles on the zinc oxide formation process. After 20 h of growth, exceptionally long ZnO nanofibers were obtained, with diameters ranging from 20 nm to 25 nm and lengths in the micrometer scale (growth rate about 8 nm/m). The nanorods produced by this method exhibit very controlled growth, which makes them promising for applications in ZnO-based gas sensors, due to the increased surface area. Their vertical and ordered arrangement is particularly advantageous for optimizing the sensing process.

采用水热法合成了从纳米棒到纳米纤维的氧化锌纳米结构。以不同的生长时间(5h、12h和20h)和不同的二氧化钛(TiO2)原子百分比(0,3和6 at%)合成样品。采用扫描电镜(SEM)进行形貌表征,x射线光电子能谱(XPS)和x射线能量色散能谱(EDS)分析化学成分。在室温下用拉曼光谱测定了其光学性质。通过SEM和EDS、XPS分析确定了ZnO纳米棒和纳米线的形成。在这项工作中,我们提出了一种以TiO2为成核中心的ZnO纳米棒的控制生长机制,而不影响晶格参数或掺杂。SEM图像显示TiO2纳米粒子对氧化锌形成过程的影响对纳米结构的生长产生了物理效应。生长20 h后,获得了直径在20 ~ 25 nm之间,长度在微米尺度(生长速率约为8 nm/m)的超长ZnO纳米纤维。通过这种方法生产的纳米棒表现出非常可控的生长,这使得它们在zno基气体传感器中的应用前景广阔,因为它们的表面积增加了。它们的垂直和有序排列特别有利于优化传感过程。
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引用次数: 0
P3HT:Borophene-ZnO P-N Junction Based Thermoelectric Generator P3HT:硼罗芬- zno P-N结基热电发电机
IF 2.5 4区 工程技术 Q3 ENGINEERING, ELECTRICAL & ELECTRONIC Pub Date : 2025-10-13 DOI: 10.1007/s11664-025-12451-z
Aysu Şahin, Nevin Taşaltın

This study presents the development and characterization of P3HT: Borophene-ZnO p-n junction-based organic thermoelectric generators (OTEGs), demonstrating superior performance compared to P3HT-ZnO systems. The incorporation of borophene significantly enhances electrical conductivity (reaching ~ 12 × 104 S/cm) while maintaining favorable Seebeck coefficients (~100–200 µV/K), particularly in the 400–500 K range, due to borophene's 2D conductive network that bridges the organic-inorganic interface. Structural analyses confirm the crystalline quality of borophene and its effective integration with P3HT. At the same time, thermoelectric tests show that the ternary composite achieves higher power factors than the binary P3HT-ZnO system, making it a promising candidate for mid-temperature waste heat recovery applications. The work advances organic thermoelectrics by optimizing the synergy between conductive 2D materials (borophene), polymers (P3HT), and metal oxides (ZnO) through innovative solution processing and junction engineering.

本研究介绍了基于P3HT: Borophene-ZnO p-n结的有机热电发生器(OTEGs)的开发和表征,与P3HT- zno系统相比,显示出优越的性能。硼罗芬的掺入显著提高了电导率(达到~ 12 × 104 S/cm),同时保持良好的塞贝克系数(~ 100-200µV/K),特别是在400-500 K范围内,由于硼罗芬的二维导电网络架起了有机-无机界面的桥梁。结构分析证实了硼罗芬的结晶质量及其与P3HT的有效结合。同时,热电测试表明,三元复合材料比二元P3HT-ZnO体系具有更高的功率因数,使其成为中温余热回收应用的有希望的候选材料。这项工作通过创新的溶液处理和结工程,优化导电二维材料(硼苯)、聚合物(P3HT)和金属氧化物(ZnO)之间的协同作用,推进了有机热电学的发展。
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引用次数: 0
期刊
Journal of Electronic Materials
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