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Integrations and applications of gallium oxide and diamond 氧化镓与金刚石的集成与应用
IF 5.1 3区 材料科学 Q2 MATERIALS SCIENCE, COATINGS & FILMS Pub Date : 2026-02-02 DOI: 10.1016/j.diamond.2026.113393
Jiayi Cai , Zhenglin Jia , Mingyang Yang , Mingxin Jiang , Xingqiao Chen , Yi Shen , Kazuhito Nishimura , Kuan W.A. Chee , Nan Jiang , Ping Cui , He Li , Qilong Yuan
Advances in technology drive transformative evolutions in next-generation semiconductor systems and multifunctional devices. Among ultrawide bandgap semiconductors (UWBG), Ga2O3 (Eg = 4.9 eV) has emerged as a promising candidate for high-voltage power electronics (>10 kV) and solar-blind ultraviolet detection, owing to its exceptional breakdown field strength (10 MV/cm) and superior Baliga figure of merit (>3000 × silicon). However, the low thermal conductivity (<30 W·m−1·K−1) and the difficulty in achieving effective p-type doping limit the practical applications of Ga2O3. As another UWBG, diamond has the highest thermal conductivity (>2000 W·m−1·K−1) among all known bulk materials and p-type doping ability, while both of which are not achievable in Ga2O3. It can be predicted that the integration of the two materials not only ameliorates thermal management issues in Ga2O3 devices, but also enables the realization of novel pn heterojunction architectures. This review summarizes the recent achievements in Ga2O3/diamond integration methods, as well as the applications of Ga2O3/diamond heterogeneous systems. Furthermore, the key challenges and future research directions are also discussed at the end of the article.
技术的进步推动了下一代半导体系统和多功能器件的变革。在超宽带隙半导体(UWBG)中,Ga2O3 (Eg = 4.9 eV)由于其优异的击穿场强(10 MV/cm)和优越的Baliga优值(3000 ×硅),已成为高压电力电子(10 kV)和太阳盲紫外探测的有希望的候选者。然而,低导热系数(<30 W·m−1·K−1)和难以实现有效的p型掺杂限制了Ga2O3的实际应用。金刚石作为另一种UWBG,在所有已知块体材料中具有最高的导热系数(>2000 W·m−1·K−1)和p型掺杂能力,而这两者在Ga2O3中是无法实现的。可以预见,两种材料的集成不仅可以改善Ga2O3器件中的热管理问题,而且可以实现新型pn异质结架构。本文综述了近年来Ga2O3/金刚石集成方法的研究进展,以及Ga2O3/金刚石非均相体系的应用。最后,对本文面临的主要挑战和未来的研究方向进行了讨论。
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引用次数: 0
Oxygen-terminated hexagonal diamond (001) surfaces for nitrogen-vacancy based quantum sensors 氮空位量子传感器用端氧六角形金刚石(001)表面
IF 5.1 3区 材料科学 Q2 MATERIALS SCIENCE, COATINGS & FILMS Pub Date : 2026-02-02 DOI: 10.1016/j.diamond.2026.113402
Bo Cui , Zhaolong Sun , Wencui Xiu , You Lv , Nan Gao , Hongdong Li
Engineering the surface chemical termination of hexagonal diamond (HD) is pivotal for the advancement of quantum sensors based on shallow nitrogen-vacancy (NV) centers. In this study, we systematically investigate the reconstruction and electronic properties of oxygen-terminated HD (001) surfaces. Our global search identifies the 0.5 ML-α and 0.75 ML-α configurations as thermally and dynamically stable surfaces, exhibiting high positive electron affinities of 3.29 eV and 3.44 eV, respectively. Crucially, these terminations effectively eliminate detrimental mid-gap surface states and associated spin noise, providing a clean bandgap environment for coherent operation. Furthermore, depth-dependent simulations identify a critical stability boundary at approximately 12 Å, where robust electronic decoupling from the (001) surface reverses proximity-induced spin quenching (from 1.65 μB to 1.96 μB) and preserves the negative charge state of the NV center against spontaneous ionization. These findings establish the O-terminated (001) surface as a superior platform for the next generation of HD-based quantum sensors, effectively resolving the trade-off between surface proximity and the preservation of intrinsic NV quantum signatures.
六方金刚石(HD)表面化学终止的工程设计是推进基于浅氮空位(NV)中心的量子传感器的关键。在本研究中,我们系统地研究了端氧HD(001)表面的重构和电子性质。我们的全局搜索发现,0.5 ML-α和0.75 ML-α配置是热稳定和动态稳定的表面,分别具有3.29 eV和3.44 eV的高正电子亲和。至关重要的是,这些终止有效地消除了有害的中隙表面态和相关的自旋噪声,为相干操作提供了干净的带隙环境。此外,深度相关的模拟确定了一个临界稳定边界约为12 Å,在该边界处,(001)表面的强大电子解耦逆转了邻近诱导的自旋猝灭(从1.65 μB到1.96 μB),并保持了NV中心的负电荷状态,防止自发电离。这些发现确立了o端(001)表面作为下一代基于hd的量子传感器的优越平台,有效地解决了表面接近性和保留固有NV量子特征之间的权衡。
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引用次数: 0
Influence of Cu doping-induced tribochemical reactions on the interfacial structure and tribological performance of a-C:H films in methane Cu掺杂诱导的摩擦化学反应对甲烷中a-C:H膜界面结构和摩擦学性能的影响
IF 5.1 3区 材料科学 Q2 MATERIALS SCIENCE, COATINGS & FILMS Pub Date : 2026-02-02 DOI: 10.1016/j.diamond.2026.113394
Dazhong Wang , Lin Chen , Chenglong Mou , Xia Li , Guangan Zhang , Deng Pan , Zhongrong Geng , Qian Meng
Methane is a globally significant clean energy source; however, the wear-induced leakage of mechanical components operating in methane environments remains a critical issue that must be addressed. Hydrogenated amorphous carbon (a-C:H) films, as solid lubricants, are key to protecting such components due to their low friction coefficient and high wear resistance. In this study, copper (Cu) doping was conducted to regulate the degree of order and methane dissociation behavior during the sliding tests of a-C:H films, utilizing its structural properties and properties of promoting molecular dissociation. Under friction induction, both a-C:H:Cu deposited at low methane pressure and a-C:H film formed graphitized homogeneous interfaces. Cu facilitated the dissociation of methane molecules at high methane pressure, enhanced surface passivation, and improved the ordering of sp2 C at the tribological interface, resulting in the formation of a heterostructure composed of a hydrogen-rich carbon layer/graphitized transfer film with ultralow friction and low wear. The alteration in interface structure revealed that the structural transformation induced by Cu, coupled with the passivation effect, synergistically governed the ultralow tribological mechanism and wear behavior of a-C:H films. Furthermore, the influence of interfacial adhesion and mechanical properties was analyzed, providing a basis for designing a-C:H films with superior tribological performance in methane environments.
甲烷是全球重要的清洁能源;然而,在甲烷环境中运行的机械部件的磨损引起的泄漏仍然是必须解决的关键问题。氢化非晶碳(a-C:H)薄膜作为固体润滑剂,由于其低摩擦系数和高耐磨性,是保护这些部件的关键。本研究利用铜(Cu)的结构特性和促进分子解离的特性,对a-C:H薄膜在滑动测试中的有序度和甲烷解离行为进行调控。在摩擦诱导下,a-C:H:Cu均在低甲烷压力下沉积,a-C:H膜均形成石墨化的均匀界面。Cu促进了甲烷分子在高甲烷压力下的解离,增强了表面钝化,改善了摩擦界面sp2 C的有序性,形成了由富氢碳层/石墨化转移膜组成的异质结构,具有超低摩擦和低磨损性能。界面结构的变化表明,Cu诱导的结构转变和钝化效应共同决定了a-C:H薄膜的超低摩擦机理和磨损性能。进一步分析了界面附着力和力学性能的影响,为设计甲烷环境下具有优异摩擦学性能的a- c:H膜提供了依据。
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引用次数: 0
Development of Fe2O3/RGO nanocomposite infused with CTAB surfactant modified glassy carbon electrode for ultrasensitive determination of promethazine hydrochloride CTAB表面活性剂修饰的Fe2O3/RGO纳米复合材料超灵敏测定盐酸异丙嗪玻碳电极的研制
IF 5.1 3区 材料科学 Q2 MATERIALS SCIENCE, COATINGS & FILMS Pub Date : 2026-02-01 DOI: 10.1016/j.diamond.2026.113387
Amruta Patri , Mallika S. Wali , Manjunath B. Megalamani , Manojna R. Nayak , Lokesh Bheemayya , Sharanappa T. Nandibewoor , Ashok M. Sajjan , Ravindra R. Kamble
A glassy carbon electrode modified with a metal oxide-reduced graphene oxide nanocomposite infused with CTAB (Fe2O3/RGO/CTAB@GCE) was engineered to enable the precise and sensitive electrochemical determination of promethazine hydrochloride (PMH). Fe2O3 and RGO nanocomposites were produced by hydrothermal and chemical processes respectively, and characterized in detail using Fourier-transform infrared spectroscopy (FTIR), X-ray diffraction (XRD), scanning electron microscopy (SEM) and atomic force microscopy (AFM). Electrochemical impedance spectroscopy (EIS) assessed material performance. Cyclic voltammetry (CV) and square wave voltammetry (SWV) were utilized to study the electrochemical behaviour and determination of PMH at the Fe2O3/RGO/CTAB@GCE. The modified electrode exhibited an enlarged electroactive surface area, strong adsorption capacity, and synergistic electrocatalytic activity towards PMH oxidation. Critical experimental parameters including electrolyte pH, nanocomposite loading, preconcentration potential, and time were systematically optimized to maximize analytical performance. Under optimized conditions, the sensor displayed a linear detection range from 6.0 nmol L−1 to 0.01 μmol L−1, with detection and quantification limits of 0.36 and 1.21 nmol L−1 respectively. The designed sensing platform demonstrated high sensitivity, excellent reproducibility, and practical applicability for PMH determination in urine, water and pharmaceutical samples.
用CTAB (Fe2O3/RGO/CTAB@GCE)修饰金属氧化物还原氧化石墨烯纳米复合材料修饰玻碳电极,实现了对盐酸异丙嗪(PMH)的精确灵敏电化学测定。采用水热法和化学法分别制备了Fe2O3和RGO纳米复合材料,并利用傅里叶变换红外光谱(FTIR)、x射线衍射(XRD)、扫描电镜(SEM)和原子力显微镜(AFM)对其进行了详细表征。电化学阻抗谱(EIS)评价了材料的性能。利用循环伏安法(CV)和方波伏安法(SWV)研究了PMH在Fe2O3/RGO/CTAB@GCE上的电化学行为和测定方法。改性后的电极具有较大的电活性表面积、较强的吸附能力和对PMH氧化的协同电催化活性。系统优化了电解液pH、纳米复合材料负载、预富集电位和时间等关键实验参数,以最大化分析性能。在优化条件下,传感器的线性检测范围为6.0 ~ 0.01 μmol L−1,检测限和定量限分别为0.36和1.21 nmol L−1。所设计的传感平台对尿液、水和药物样品中PMH的检测具有高灵敏度、良好的重现性和实用性。
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引用次数: 0
Synthesis of p-n junction via titanate nanobelts grown on graphite/carbon nanotubes for augmented organic pollutant degradation 石墨/碳纳米管上钛酸盐纳米带合成p-n结以增强有机污染物降解
IF 5.1 3区 材料科学 Q2 MATERIALS SCIENCE, COATINGS & FILMS Pub Date : 2026-02-01 DOI: 10.1016/j.diamond.2026.113366
Sabrine Zghal , Ilyes Jedidi , Mohamed Salah Mahmoud , Marc Cretin , Sophie Cerneaux , Makki Abdelmouleh
In this work, titanate nanobelts (TNBs) were successfully grown via hydrothermal synthesis onto the surface of as-prepared carbon graphite/carbon nanotubes composite material. Titanium (IV) butoxide was used as precursor for the synthesis of TNBs, following a basic hydrolysis-condensation sol-gel reaction. Morphological characterization of the nanocomposites by SEM indicated the achieved good growth of TNBs onto the surface of carbon nanotubes (CNTs) and graphite supports. The specific surface area, determined by BET, increased significantly from pure graphite carbon KS44 (6.23 m2/g) to carbon support KS44/CNT/TNB enriched with TNBs and CNTs (161.67 m2/g). On the other hand, the visible light absorption spectrum increased with TNB-based composites. A remarkable enhancement in absorption in the visible region achieved a 1000% enhancement for KS44/CNT/TNB relative to KS44 alone, which explains the improvement of its photocatalytic degradation capacity of AO7. The results obtained by UV–visible and XPS show that the simultaneous presence of TNBs and CNTs on graphite-based composites (KS44/CNT/TNB) gives the material the necessary properties to be used as an adsorbent and catalyst in wastewater treatment, and in particular for the removal and degradation of azo dyes in aqueous solution.
本研究通过水热法在制备好的碳石墨/碳纳米管复合材料表面成功生长钛酸盐纳米带(TNBs)。以丁氧化钛(IV)为前驱体,经碱性水解-缩合-溶胶-凝胶反应合成tnb。SEM形貌表征表明,纳米复合材料在碳纳米管和石墨载体表面生长良好。BET测定的比表面积从纯石墨碳KS44 (6.23 m2/g)显著增加到富含TNB和CNTs的碳载体KS44/CNT/TNB (161.67 m2/g)。另一方面,tnb基复合材料的可见光吸收光谱增加。与单独的KS44相比,KS44/CNT/TNB在可见光区的吸收显著增强,提高了1000%,这解释了其光催化降解AO7能力的提高。紫外-可见和XPS结果表明,在石墨基复合材料(KS44/CNT/TNB)上同时存在TNB和CNTs使该材料具有必要的性能,可作为废水处理中的吸附剂和催化剂,特别是用于去除和降解水溶液中的偶氮染料。
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引用次数: 0
Synergistic hydrogen plasma etching and in situ oxidation of boron-doped diamond for enhanced electrochemical ozone production 协同氢等离子体蚀刻和硼掺杂金刚石的原位氧化增强电化学臭氧生产
IF 5.1 3区 材料科学 Q2 MATERIALS SCIENCE, COATINGS & FILMS Pub Date : 2026-02-01 DOI: 10.1016/j.diamond.2026.113382
Lipeng Zhao , Yicheng Jiang , Shengli Zhu , Zhenduo Cui , Zhaoyang Li , Wence Xu , Zhonghui Gao , Meiqing Guo , Yanqin Liang , Hui Jiang
Boron-doped diamond (BDD) electrodes have attracted considerable attention as promising candidates for electrochemical ozone production (EOP) in extreme and corrosive environments, due to their exceptional chemical and physical stability. However, the inherently low ozone generation efficiency has significantly hindered their widespread application in EOP processes. In this study, a hydrogen plasma etching strategy was developed to fabricate hydrogen-terminated BDD electrodes, which undergo in situ oxidation during the anodic reaction, thereby transforming the surface termination from hydrogen to oxygen. This surface-engineering approach markedly enhances the electrode's electrocatalytic activity for ozone generation. Experimental results demonstrated that, compared to the as-deposited BDD electrode, the sample etched for 1.5 h at a chamber temperature of 700 °C and a hydrogen flow rate of 300 sccm (labeled as BDD-H1.5h) exhibited a significantly increased electrochemical active area (ECSA) and a decreased charge transfer resistance (Rct). As a result, the ozone production rate of the BDD-H1.5h electrode was 2.66 times higher than that of the untreated BDD electrode, with a Faradaic efficiency (FE) of 17.23%. Theoretical calculations further revealed that the combination of appropriate hydrogen plasma etching and in situ oxidation leads to the enrichment of C-O-C and C-OH functional groups on the electrode surface. These surface species significantly enhance the adsorption of the OH intermediate, which plays a pivotal role in the ozone oxidation pathway. Therefore, the BDD-H1.5h electrode exhibits excellent performance in the electrocatalytic ozonation of the representative organic dye pollutant Acid Red 27 (AR 27). This highlights the great potential of modified BDD electrodes for efficient ozone generation and organic pollutant removal in water treatment applications.
掺硼金刚石(BDD)电极由于其优异的化学和物理稳定性,作为在极端和腐蚀环境下电化学臭氧生产(EOP)的有希望的候选者,引起了人们的广泛关注。然而,固有的低臭氧生成效率严重阻碍了它们在EOP工艺中的广泛应用。在本研究中,开发了一种氢等离子体刻蚀策略来制作端氢BDD电极,该电极在阳极反应过程中进行原位氧化,从而将表面端氢转变为氧。这种表面工程方法显著提高了电极对臭氧生成的电催化活性。实验结果表明,与沉积的BDD电极相比,在700°C的腔室温度和300 sccm的氢气流速下蚀刻1.5h的样品(标记为BDD- h1.5 h)的电化学活性面积(ECSA)显著增加,电荷转移电阻(Rct)显著降低。结果表明,BDD- h1.5 h电极的臭氧产率是未处理BDD电极的2.66倍,其法拉第效率(FE)为17.23%。理论计算进一步表明,适当的氢等离子体刻蚀和原位氧化相结合可以使电极表面的C-O-C和C-OH官能团富集。这些表面物质显著增强了OH -中间物的吸附,这在臭氧氧化途径中起着关键作用。因此,BDD-H1.5h电极在典型有机染料污染物酸性红27 (AR 27)的电催化臭氧化中表现出优异的性能。这凸显了改性BDD电极在水处理应用中高效臭氧生成和有机污染物去除方面的巨大潜力。
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引用次数: 0
Interface-regulated ZnO/ZnFe2O4 composites with enhanced pseudocapacitive lithium storage 界面调节ZnO/ZnFe2O4复合材料增强赝电容锂存储
IF 5.1 3区 材料科学 Q2 MATERIALS SCIENCE, COATINGS & FILMS Pub Date : 2026-02-01 DOI: 10.1016/j.diamond.2026.113385
Jie Yang , Hengrui Qiu , Qi Liu , Ping Bai , Yongqiang Zhang , Wenxiu He
Metal–organic framework (MOF)–derived ZnFe2O4-based anode materials have attracted increasing interest for lithium-ion batteries (LIBs) because of their high theoretical capacity and rich multi-electron redox chemistry. However, their practical application is still severely hindered by pronounced volume variation, structural pulverization, and unstable electrode–electrolyte interfaces during repeated lithiation/delithiation processes. These issues cannot be fully mitigated by compositional optimization or morphological control alone. Herein, a polyvinylpyrrolidone (PVP)-assisted Zeolitic Imidazolate Framework-8 (ZIF-8)-derived strategy is proposed to regulate precursor evolution and interfacial architecture, enabling the rational construction of nitrogen-doped carbon-modified ZnO/ZnFe2O4 heterostructured anodes. The introduction of PVP during the coordination self-assembly process effectively modulates the formation of a ZnFe-MOF-like precursor and its subsequent phase evolution during thermal treatment. As a result, uniformly distributed ZnO/ZnFe2O4 heterostructures are successfully embedded within a conductive N-doped carbon framework, which provides effective mechanical buffering and enhanced interfacial coupling. The synergistic integration of heterostructure engineering and N-doped carbon modification significantly promotes charge transfer kinetics, stabilizes the electrode–electrolyte interface, and alleviates structural degradation during cycling. Benefiting from these structural advantages, the optimized N-C/ZnFe2O4/ZnO-0.3 electrode delivers a high reversible capacity of 1487 mAh g−1 at 0.1 A g−1 and maintains a stable capacity of 569.2 mAh g−1 after 500 cycles at 1 A g−1. This work highlights the critical role of precursor regulation and interfacial engineering in MOF-derived conversion-type anodes and provides a feasible strategy for the rational design of high-performance LIB anode materials.
金属有机骨架(MOF)衍生的znfe2o4基负极材料因其较高的理论容量和丰富的多电子氧化还原化学性质而越来越受到锂离子电池(LIBs)的关注。然而,它们的实际应用仍然受到反复锂化/去锂化过程中明显的体积变化、结构粉化和不稳定的电极-电解质界面的严重阻碍。这些问题不能完全减轻成分优化或形态控制单独。本文提出了一种聚乙烯吡咯烷酮(PVP)辅助咪唑酸分子筛骨架-8 (ZIF-8)衍生策略来调节前驱体演化和界面结构,从而实现氮掺杂碳修饰ZnO/ZnFe2O4异质结构阳极的合理构建。在配位自组装过程中引入PVP有效地调节了znfe - mof样前驱体的形成及其在热处理过程中的后续相演化。结果表明,均匀分布的ZnO/ZnFe2O4异质结构成功嵌入到导电n掺杂碳框架中,提供了有效的机械缓冲和增强的界面耦合。异质结构工程和n掺杂碳改性的协同集成显著促进了电荷转移动力学,稳定了电极-电解质界面,减轻了循环过程中的结构降解。得益于这些结构优势,优化后的N-C/ZnFe2O4/ZnO-0.3电极在0.1 ag - 1下可提供1487 mAh g - 1的高可逆容量,并在1 ag - 1下循环500次后保持569.2 mAh g - 1的稳定容量。这项工作强调了前驱体调控和界面工程在mof衍生转化型阳极中的关键作用,并为高性能锂电池阳极材料的合理设计提供了可行的策略。
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引用次数: 0
Optimization of L-cysteine as a nitrogen and sulfur source in carbon dots synthesized from shrimp shells for supercapacitor electrodes l -半胱氨酸作为超级电容器电极碳点氮硫源的优化
IF 5.1 3区 材料科学 Q2 MATERIALS SCIENCE, COATINGS & FILMS Pub Date : 2026-02-01 DOI: 10.1016/j.diamond.2026.113391
Muhammadin Hamid , Noor Haida Mohd Kaus , Isnaeni Isnaeni , Syahrul Humaidi , Nursal , Hadi Wijoyo , Dwi Puspita Sari , Suresh Sagadevan
Nitrogen and Sulfur Co-doped Carbon Dots (NS-CDs) are synthesized from shrimp shell biomass waste, and L-cysteine, as the carbon source and dopant, using a microwave-assisted method. This study explores the use of biomass waste to develop sustainable high-performance electrode materials for supercapacitors. The synthesized NS-CDs has exhibited the agglomeration of the particle in the diameter ranging from 80 to 100 nm. X-ray diffraction (XRD) analysis has confirmed the characteristic diffraction peaks corresponding to the graphitic carbon planes (002) and (001), while spectroscopic methods further validate the successful incorporation of nitrogen and sulfur dopants by detecting functional groups such as N=C=S. Electrochemical evaluation shows that the sample with a 1:1 ratio of shrimp shell to L-cysteine provides optimal performance, achieving a specific capacitance of 490.22 F/g, the lowest internal resistance of 3.92 Ω, and the highest electrical conductivity of 452.49 S/cm. Furthermore, this optimal sample reaches an energy density of 109.15 Wh/kg and a power density of nearly 598 W/kg. These results demonstrate that shrimp shell-derived NS-CDs could be a promising candidate for sustainable electrode materials in supercapacitor applications.
以虾壳生物质废弃物为原料,以l -半胱氨酸为碳源和掺杂剂,采用微波辅助法制备了氮硫共掺杂碳点(NS-CDs)。本研究探索利用生物质废弃物开发可持续高性能超级电容器电极材料。合成的NS-CDs在粒径80 ~ 100 nm范围内均有团聚现象。x射线衍射(XRD)分析证实了石墨碳面(002)和(001)对应的特征衍射峰,而光谱方法通过检测N=C=S等官能团进一步验证了氮和硫掺杂剂的成功掺入。电化学评价表明,虾壳与l -半胱氨酸比例为1:1的样品性能最佳,比电容为490.22 F/g,内阻最低为3.92 Ω,电导率最高为452.49 S/cm。此外,该最佳样品的能量密度达到109.15 Wh/kg,功率密度接近598 W/kg。这些结果表明,虾壳衍生的NS-CDs可能是超级电容器应用中可持续电极材料的有希望的候选材料。
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引用次数: 0
High-temperature oxygen plasma etching for enhancing the electrochemical oxidation performance of boron-doped diamond electrodes 提高掺硼金刚石电极电化学氧化性能的高温氧等离子体刻蚀
IF 5.1 3区 材料科学 Q2 MATERIALS SCIENCE, COATINGS & FILMS Pub Date : 2026-01-31 DOI: 10.1016/j.diamond.2026.113364
Hao Wu , Haichao Li , Zejun Deng , Jie Wang , Rongkai Ge , Yijia Wang , Kechao Zhou , Quiping Wei , Li Ma
Boron-doped diamond (BDD) electrodes are recognized as highly promising anodes for electrochemical advanced oxidation processes owing to the wide potential window, high stability, and superior electrochemical oxidation capability. Nevertheless, their practical applications are limited by electrochemically active surface area (EASA) and insufficient mass transfer efficiency. In this work, a strategy of oxygen plasma etching at different temperatures (550 °C, 650 °C, and 750 °C) was employed to enhance the electrochemical oxidation performance of BDD anodes. Increasing the etching temperature intensifies the etching of crystal facets, leading to the formation of nanopores at 650 °C, while excessive etching at 750 °C results in grain fragmentation. The plasma-induced morphological evolution increased the EASA and facilitated interfacial mass transfer, thereby substantially improving the electrochemical oxidation efficiency. Among the etched electrodes, 650 °C-BDD has the highest EASA, with a degradation rate constant of 3.89 ± 0.11 h−1 for Reactive Blue 19 (RB-19), which is close to a sixfold enhancement compared with that of pristine BDD. Moreover, the TOC removal rate of the 650 °C-BDD electrode was nearly 2.4 times higher than that of pristine BDD, while reducing the TOC energy consumption by about 35.2%. These results demonstrate a clear correlation between oxygen plasma etching temperature, BDD surface morphology, and electrochemical oxidation efficiency, thereby providing practical guidance for the rational design of high-performance diamond anodes in advanced wastewater treatment applications.
掺硼金刚石(BDD)电极具有宽电位窗、高稳定性和优异的电化学氧化性能,是一种非常有前途的电化学高级氧化阳极。然而,它们的实际应用受到电化学活性表面积(EASA)和传质效率不足的限制。本文采用不同温度(550°C、650°C和750°C)下的氧等离子体刻蚀策略来提高BDD阳极的电化学氧化性能。升高刻蚀温度会加剧晶面的刻蚀,在650℃时形成纳米孔,而在750℃时过度刻蚀则会导致晶粒破碎。等离子体诱导的形态演化增加了EASA,促进了界面传质,从而大大提高了电化学氧化效率。其中,650°C-BDD的EASA最高,对活性蓝19 (RB-19)的降解速率常数为3.89±0.11 h−1,比原始BDD提高了近6倍。650℃-BDD电极的TOC去除率是原始BDD电极的近2.4倍,TOC能耗降低约35.2%。这些结果证明了氧等离子体刻蚀温度、BDD表面形貌和电化学氧化效率之间存在明显的相关性,从而为废水深度处理应用中高性能金刚石阳极的合理设计提供了实践指导。
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引用次数: 0
First-principles screening of 1D van der Waals heterostructures based on oligochalcogenophenes encapsulated within 1D crystal nanotubes for stable and efficient excitonic solar cells 基于低聚乙醇烯的一维晶体纳米管内范德华异质结构的第一性原理筛选,用于稳定高效的激子太阳能电池
IF 5.1 3区 材料科学 Q2 MATERIALS SCIENCE, COATINGS & FILMS Pub Date : 2026-01-31 DOI: 10.1016/j.diamond.2026.113383
S. Elhadfi , J. Chenouf
The power conversion efficiency (PCE) of excitonic solar cells (XSCs) based on organic semiconductors has reached over 20%. However, the combination of high PCE and long-term stability is still a major conundrum of commercialization. To achieve this goal, we highlight here a promising strategy based on exploiting the empty space within 1D crystal nanotubes (NTs) to encapsulate photoactive organic molecules, creating 1D van der Waals heterostructures (1D vdWHTs) with tunable optoelectronic properties. Aiming to provide theoretical guidance for the rapid selection of 1D vdWHTs based on NTs encapsulating π-conjugated molecules towards stable and efficient XSCs, comprehensive first-principles calculations are carried out to study the energetic stability, optoelectronic behavior, and photovoltaic potential of single-walled carbon, boron-phosphide, and germanium-carbide NTs filled with a series of π-conjugated oligochalcogenophenes (nX). We demonstrate that the host NTs combined with the guest nX can provide XSCs with tunable optoelectronic properties, electron-donor/electron-acceptor interface band alignment, and PCE. Intriguingly, we evidence that including the contribution of nX electron-acceptors with strong NIR/visible absorption can significantly enhance the PCE, potentially reaching over 28%. This work emphasizes the importance of nX@NTs-based 1D vdWHTs strategy in tuning the photovoltaic performances, leading to development of novel heterostructures for stable and efficient XSCs.
基于有机半导体的激子太阳能电池(XSCs)的功率转换效率(PCE)达到20%以上。然而,高PCE和长期稳定性的结合仍然是商业化的主要难题。为了实现这一目标,我们在这里强调了一种有前途的策略,该策略基于利用一维晶体纳米管(NTs)内的空白空间来封装光活性有机分子,从而创建具有可调谐光电特性的一维范德华异质结构(1D vdWHTs)。为了给基于纳米碳管封装π共轭分子的一维vdWHTs快速选择提供理论指导,本文采用第一性原理计算方法,研究了填充一系列π共轭寡硫基苯(nX)的单壁碳纳米碳管、磷化硼纳米碳管和碳化锗纳米碳管的能量稳定性、光电行为和光伏电位。我们证明了宿主NTs与客体nX结合可以为XSCs提供可调谐的光电性能,电子-供体/电子-受体界面带对准和PCE,有趣的是,我们证明了包括具有强近红外/可见吸收的nX电子受体的贡献可以显着提高PCE,可能达到28%以上。这项工作强调nX@NTs-based 1D vdWHTs策略在调整光伏性能方面的重要性,从而开发出稳定高效的XSCs的新型异质结构。
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Diamond and Related Materials
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