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Targeted doping modulation of electrical conductivity and electronic state structure in lithium niobate 铌酸锂电导率和电子态结构的定向掺杂调制
IF 2 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2026-01-26 DOI: 10.1186/s40712-025-00397-3
Mohamed Beriniz, Abdelghani Khalil, ALi Amkor, Noureddine El Barbri, Kamal Maaider

This study presents an integrated theoretical approach combining ab initio density functional theory (DFT) simulations with a new analytical model of the ferroelectric phase transition that accounts for interactions between both first and second neighbors in pure and magnesium-doped lithium niobate (LiNbO₃, LN). This framework enables the characterization of the evolution of ionic conductivity as a function of temperature and Mg concentration, as well as the variation of the Curie temperature (TC) with doping level. In parallel, DFT calculations provide insight into the effect of Mg doping on the electronic density of states (DOS) and band structure. By applying vacancy-based models (a mixed model and two models referred to as 1 and 2) to both pure and Mg-doped LiNbO₃, we obtain good agreement with experimental data for ionic conductivity and Curie temperature. At constant temperature, the ionic conductivity of Mg-doped LiNbO₃, increases up to a critical Mg concentration of approximately 3.4%, which is attributed to a reduction in Nb antisite defects (NbLi) and a narrowing of the band gap, leading to an effective n-type behavior. Beyond this threshold, the conductivity gradually decreases due to band gap widening and the formation of additional structural defects. Overall, this integrated approach advances the understanding of transport mechanisms in Mg-doped LiNbO₃, and provides valuable guidance for optimizing acoustic and optoelectronic devices based on this material.

该研究提出了一种综合的理论方法,将从头算密度泛函理论(DFT)模拟与铁电相变的一种新的分析模型相结合,该模型考虑了纯铌酸锂和掺镁铌酸锂(LiNbO₃,LN)中第一邻居和第二邻居之间的相互作用。该框架能够表征离子电导率随温度和Mg浓度的变化,以及居里温度(TC)随掺杂水平的变化。同时,DFT计算提供了Mg掺杂对电子态密度(DOS)和能带结构的影响。通过将基于空位的模型(一个混合模型和两个模型称为1和2)应用于纯LiNbO₃和掺杂mg的LiNbO₃,我们得到了离子电导率和居里温度与实验数据很好的一致性。在恒定温度下,掺镁LiNbO₃的离子电导率增加到临界Mg浓度约3.4%,这是由于Nb对位缺陷(NbLi)的减少和带隙的缩小,导致了有效的n型行为。超过这个阈值后,由于带隙变宽和形成额外的结构缺陷,电导率逐渐降低。总的来说,这种集成方法促进了对mg掺杂LiNbO₃输运机制的理解,并为优化基于该材料的声学和光电子器件提供了有价值的指导。
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引用次数: 0
Development and optimization of natural dye-based crayons from Rumex abyssinicus using Box-Behnken methodology 用Box-Behnken方法开发和优化阿比西尼鼠天然染料蜡笔
IF 2 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2026-01-24 DOI: 10.1186/s40712-026-00407-y
Naol Bekele, Mikiyas Abewaa Gnaro, Ashagrie Mengistu Kebede

This study presents the first exploration of natural dye extracted from Rumex abyssinicus for crayon formulation, leveraging its local availability and environmental sustainability. The work focused on evaluating the effects of paraffin wax, talc, extracted dye, and temperature on the crayon's properties. Characterization techniques, including UV–vis spectroscopy, Fourier-transform infrared spectroscopy (FTIR), thermogravimetric analysis (TGA), tensile strength testing, visibility, and durability assessments, were employed to analyze the formulated crayon. A Box-Behnken design within the Response Surface Methodology framework was used to optimize the formulation by varying paraffin wax (4, 6 and 8 g), dye (0.5, 1.25 and 2 g), talc (5, 7 and 9 g), and temperature (80, 90 and 100 °C), while keeping stearic acid (0.5 g) and beeswax (1 g) constant. UV–vis spectroscopy revealed a maximum absorbance of 0.830 at λmax of 298.7 nm, indicating strong pigment retention. The crayon exhibited a tensile strength of 1.48 N/mm2 and a percentage elongation at break of 1.34%, reflecting its durability and flexibility. These findings demonstrate the feasibility of utilizing Rumex abyssinicus dye in eco-friendly crayon production, offering a sustainable alternative with desirable mechanical and aesthetic properties.

本研究首次探索了从深海蛤蚌中提取的天然染料用于蜡笔配方,利用其在当地的可用性和环境的可持续性。研究了石蜡、滑石粉、萃取染料和温度对蜡笔性能的影响。表征技术,包括紫外-可见光谱、傅里叶变换红外光谱(FTIR)、热重分析(TGA)、拉伸强度测试、可见性和耐久性评估,被用于分析配方蜡笔。在响应面法框架内采用Box-Behnken设计,通过改变石蜡(4、6和8 g)、染料(0.5、1.25和2 g)、滑石粉(5、7和9 g)和温度(80、90和100℃),同时保持硬脂酸(0.5 g)和蜂蜡(1 g)不变,对配方进行优化。紫外可见光谱显示,在λmax为298.7 nm处,最大吸光度为0.830,表明颜料保留性强。该蜡笔的抗拉强度为1.48 N/mm2,断裂伸长率为1.34%,反映了其耐久性和柔韧性。这些发现证明了在生态友好型蜡笔生产中使用阿比西尼鼠染料的可行性,提供了一种具有理想机械和美学性能的可持续替代品。
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引用次数: 0
Sustainable building mineral foam insulation: mix design and performance analysis of a low-carbon formulation 可持续建筑矿物泡沫保温材料:低碳配方的混合设计和性能分析
IF 2 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2026-01-23 DOI: 10.1186/s40712-025-00393-7
Matthieu Croo, Vincent Dubois, Alain Bataille, Jérôme Lefebvre, Alexandre Leblanc, Éric Wirquin

Building insulation is currently one of the biggest challenges to reduce energy consumption. Saving energy also means reducing the human impact on Environment. In order to reduce this impact, the manufacturing of the building materials is of importance. Moreover, policies, laws and regulations keep evolving in this direction. Mineral insulation foams are mainly composed of cement or gypsum. In mentioned context, an evolution of mineral insulating foams is necessary. This paper proposes promising low carbon mineral foams. The insulating foam, produced by a direct foaming method, aims at having a thermal conductivity lower 0.065W/m/K combined with a compressive strength higher than 0.2 MPa. Therefore, in this research, binder has been replaced by hydraulic lime and used with a bio-sourced foaming agent, locally produced. Limestone Clay Fines (LCF), considered as waste, have been added in the formulation up to 25% of the binder and LCF addition also improved the foaming of the mixture by more than 70%. 12,5% of Sulfo-Aluminous Cement (SAC) was used and has a key role in the setting process. Superplasticizer was also used to reduce water consumption, which accounts for half of the total mass of raw materials, and allows quantity adjustment of SAC. Mixing process choices and more precisely mixing equipment, can also have a significant impact. Indeed, the use of whisk, in place of a blade, produces more quickly a 28% lighter foam. Comparing with other insulating materials, this mineral foam presents one of the lowest CO2 equivalent emissions and also one of the lowest drinking net water consumptions. Moreover, the specificities of this insulating foam pores give to this new material interesting acoustic performances. Indeed, the processed foams are five times better acoustically than aerated concrete. In fact, the internal structure of the mineral foam absorbs up to 80% of low wavelengths.

建筑保温是当前降低能耗的最大挑战之一。节约能源也意味着减少人类对环境的影响。为了减少这种影响,建筑材料的制造非常重要。此外,政策、法律和法规也在朝着这个方向不断发展。矿物保温泡沫主要由水泥或石膏组成。在上述情况下,矿物绝缘泡沫的发展是必要的。本文提出了有前途的低碳矿物泡沫。采用直接发泡法生产的保温泡沫,其目标是导热系数低于0.065W/m/K,抗压强度高于0.2 MPa。因此,在本研究中,粘合剂已被液压石灰取代,并与当地生产的生物源发泡剂一起使用。石灰石粘土粉(LCF)被认为是废物,在配方中添加了高达25%的粘结剂,LCF的添加也使混合物的发泡性提高了70%以上。使用了12.5%的硫铝水泥(SAC),在固化过程中起着关键作用。还使用了高效减水剂,减少了占原料总质量一半的用水量,并允许SAC的数量调整。混合工艺的选择和更精确的混合设备,也会产生重大的影响。事实上,用打蛋器代替刀片可以更快地产生轻28%的泡沫。与其他绝缘材料相比,这种矿物泡沫是二氧化碳当量排放量最低的材料之一,也是饮用净用水量最低的材料之一。此外,这种绝缘泡沫孔的特殊性使这种新材料具有有趣的声学性能。事实上,经过处理的泡沫材料的声学效果是加气混凝土的五倍。事实上,矿物泡沫的内部结构吸收高达80%的低波长。
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引用次数: 0
Wear and tribological analysis of graphite-reinforced Al6061-TiB2 hybrid composites fabricated by stir casting 搅拌铸造石墨增强Al6061-TiB2杂化复合材料的磨损摩擦学分析
IF 2 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2026-01-19 DOI: 10.1186/s40712-025-00380-y
Haiter Lenin Allasi, S. Suresh, C. Emmy Prema, Sujin Jose Arul, Mary Vasanthi Soosaimariyan

This study investigates the Al6061-TiB2-Gr hybrid composites developed by high-energy stir casting with varying TiB2 (5, 10, 15, and 20 wt.%) and fixed graphite (2 wt.%). The research focuses on both chemical and tribological characterization. The phase composition and elemental analysis were examined using SEM and EDS, confirming uniform distribution and strong bonding of reinforcements. Wear tests were conducted using a pin-on-disc setup under different loads (5–15 N) and sliding distances (1000–3000 m). The response surface methodology (RSM) and ANOVA were employed to model the effects of reinforcement content, load, and sliding distance on wear rate and friction coefficient. The Al6061-20TiB2-2Gr composite exhibited a 68% reduction in wear rate and 71% lower friction compared with the base alloy. The combination of hard TiB2 and self-lubricating graphite enhanced surface protection, resulting in smoother wear morphology. The study confirms that the optimized hybrid composite provides superior tribological performance and chemical stability, suitable for eco-efficient engineering applications.

采用高能搅拌铸造技术制备了不同TiB2(5、10、15、20 wt.%)和固定石墨(2 wt.%)的Al6061-TiB2-Gr复合材料。研究的重点是化学和摩擦学表征。利用扫描电镜和能谱仪对合金的相组成和元素分析进行了分析,证实了增强剂分布均匀,结合牢固。在不同载荷(5-15 N)和滑动距离(1000-3000 m)下,使用销盘设置进行磨损测试。采用响应面法(RSM)和方差分析(ANOVA)建立了钢筋含量、载荷和滑动距离对磨损率和摩擦系数的影响模型。与基体合金相比,Al6061-20TiB2-2Gr复合材料的磨损率降低68%,摩擦率降低71%。硬TiB2和自润滑石墨的结合增强了表面保护,使磨损形貌更光滑。研究证实,优化后的混合复合材料具有优异的摩擦学性能和化学稳定性,适用于生态高效的工程应用。
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引用次数: 0
Structure and activity relationship of rGO–V2O5/Nb composites in the photocatalytic removal of dyes rGO-V2O5 /Nb复合材料光催化脱除染料的结构与活性关系
IF 2 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2026-01-14 DOI: 10.1186/s40712-025-00400-x
L. J. Cardenas-Flechas, D. F. Avendaño-Rodríguez, N. Fernández-Barrero, D. M. Cuesta-Parra, Irais Mata Guzmán, María A. Acosta, O. Chamarraví-Guerra

In this study, Nb-doped V2O5/rGO composites were synthesized via the hydrothermal method, with reduced graphene oxide contents ranging from 0 to 15% to evaluate their photocatalytic performance in the degradation of methyl orange (MO), rhodamine B (RhB), and malachite green (MG) under UV light. XRD analysis with Rietveld refinement confirmed the stabilization of the orthorhombic alpha-V2O5 phase, where the presence of Nb2O5 signals and a shift in diffraction peaks evidenced lattice expansion induced by doping. Furthermore, XPS analysis revealed the coexistence of mixed oxidation states (V4+/V5+) and the formation of oxygen vacancies, which are critical for charge transfer. Morphological characterization by SEM showed a structural evolution from microplates in the rGO-free material to a porous network of interconnected nanosheets at 15% rGO. Although thermal stability improved with rGO content, the 5% rGO composite exhibited the optimal photocatalytic activity, achieving removal efficiencies exceeding 90% for RhB and MG. The degradation of malachite green was found to be strongly pH-dependent, suggesting that electrostatic interactions govern the adsorption mechanism. These results point to a synergistic effect between Nb-doping and the rGO network, promoting an efficient Z-scheme charge transfer mechanism.

本研究通过水热法合成了nb掺杂的V2O5/rGO复合材料,氧化石墨烯的还原含量为0 ~ 15%,以评价其在紫外光下降解甲基橙(MO)、罗丹明B (RhB)和孔雀石绿(MG)的光催化性能。Rietveld细化的XRD分析证实了正交α - v2o5相的稳定性,其中Nb2O5信号的存在和衍射峰的移位证明了掺杂引起的晶格膨胀。此外,XPS分析还揭示了混合氧化态(V4+/V5+)的共存和氧空位的形成,这是电荷转移的关键。扫描电镜形态学表征表明,在15%氧化石墨烯条件下,无氧化石墨烯材料的微孔板结构演变为相互连接的纳米片多孔网络。虽然热稳定性随着还原氧化石墨烯含量的增加而提高,但5%还原氧化石墨烯复合材料表现出最佳的光催化活性,对RhB和MG的去除率超过90%。孔雀石绿的降解具有很强的ph依赖性,表明静电相互作用支配着吸附机制。这些结果表明nb掺杂与还原氧化石墨烯网络之间存在协同效应,促进了有效的Z-scheme电荷转移机制。
{"title":"Structure and activity relationship of rGO–V2O5/Nb composites in the photocatalytic removal of dyes","authors":"L. J. Cardenas-Flechas,&nbsp;D. F. Avendaño-Rodríguez,&nbsp;N. Fernández-Barrero,&nbsp;D. M. Cuesta-Parra,&nbsp;Irais Mata Guzmán,&nbsp;María A. Acosta,&nbsp;O. Chamarraví-Guerra","doi":"10.1186/s40712-025-00400-x","DOIUrl":"10.1186/s40712-025-00400-x","url":null,"abstract":"<div>\u0000 \u0000 <p>In this study, Nb-doped V<sub>2</sub>O<sub>5</sub>/rGO composites were synthesized via the hydrothermal method, with reduced graphene oxide contents ranging from 0 to 15% to evaluate their photocatalytic performance in the degradation of methyl orange (MO), rhodamine B (RhB), and malachite green (MG) under UV light. XRD analysis with Rietveld refinement confirmed the stabilization of the orthorhombic alpha-V2O5 phase, where the presence of Nb<sub>2</sub>O<sub>5</sub> signals and a shift in diffraction peaks evidenced lattice expansion induced by doping. Furthermore, XPS analysis revealed the coexistence of mixed oxidation states (V<sup>4+</sup>/V<sup>5+</sup>) and the formation of oxygen vacancies, which are critical for charge transfer. Morphological characterization by SEM showed a structural evolution from microplates in the rGO-free material to a porous network of interconnected nanosheets at 15% rGO. Although thermal stability improved with rGO content, the 5% rGO composite exhibited the optimal photocatalytic activity, achieving removal efficiencies exceeding 90% for RhB and MG. The degradation of malachite green was found to be strongly pH-dependent, suggesting that electrostatic interactions govern the adsorption mechanism. These results point to a synergistic effect between Nb-doping and the rGO network, promoting an efficient Z-scheme charge transfer mechanism.</p>\u0000 </div>","PeriodicalId":592,"journal":{"name":"International Journal of Mechanical and Materials Engineering","volume":"21 1","pages":""},"PeriodicalIF":2.0,"publicationDate":"2026-01-14","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://link.springer.com/content/pdf/10.1186/s40712-025-00400-x.pdf","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"147338829","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Performance evaluation of a domestic vapor compression refrigeration system using periwinkle-shell-derived CaO-rich nano-lubricant in mineral oil 使用长春花壳衍生的矿物油富曹纳米润滑剂的家用蒸汽压缩制冷系统性能评价
IF 2 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2026-01-13 DOI: 10.1186/s40712-025-00395-5
Mfon Udoh, Loto Roland Tolulope, Olayinka Soledayo Ohunakin, Ozogbu Joy Adaeze

This study presents a novel approach to improving the performance of domestic vapor compression refrigeration systems (VCRS) through a bio-synthesized nano-lubricant derived from periwinkle shells, a biodegradable waste material. Periwinkle-shell-derived CaO-rich nanoparticles (PSD–CaO nanoparticles) were synthesized via a sustainable method Al2(SO4)3 as a precursor, marking the first application of PSD–CaO nanoparticles in refrigeration. Although bulk composition shows significant SiO2 inherited from the shell matrix, the active nanomaterial consists of crystalline CaO domains responsible for the observed performance enhancement. Experimental evaluation showed that at 0.1 M concentration, the 0.036 wt.% CaO-rich nanoparticle + mineral oil (M.O.) blend achieved the lowest energy consumption (0.3832 kWh) and power consumption, attributed to enhanced thermal conductivity and reduced friction. Conversely, pure M.O. outperformed nano-lubricant blends at 0.3 M concentration, where nanoparticle agglomeration increased viscosity and reduced lubrication efficiency. At 0.1 M, the 0.06 wt.% CaO-rich nanoparticle + M.O. achieved the lowest pressure ratio, indicating optimal lubrication. Cooling capacity was highest at 0.05 wt.% CaO-rich nanoparticle + M.O. (0.3 M) and 0.08 wt.% CaO-rich nanoparticle + M.O. (0.1 M). The coefficient of performance (COP) peaked at 0.05 wt.% (0.3 M) and 0.024 wt.% (0.1 M), underscoring the importance of nanoparticle dispersion in maximizing thermal efficiency. However, none of the tested configurations met the ISO requirement for pull-down to –12 °C, highlighting limitations in deep cooling capability. The key novelty lies in the eco-friendly synthesis of CaO-rich nanoparticles from waste periwinkle shells, demonstrating a pathway toward waste valorization and energy efficiency. Aligned with Sustainable Development Goals (SDGs) 11.6 and 13.3, this research shows the potential of bio-derived nano-lubricants to enhance VCRS performance, with optimal nanoparticle concentration being central to sustainable refrigeration design.

本研究提出了一种新的方法,通过从长春花贝壳(一种可生物降解的废物)中提取生物合成的纳米润滑剂来提高家用蒸汽压缩制冷系统(VCRS)的性能。采用可持续的方法合成了紫花螺壳衍生的富cao纳米颗粒(PSD-CaO纳米颗粒),这标志着PSD-CaO纳米颗粒首次应用于制冷领域。虽然整体组成显示大量的SiO2继承自壳基质,但活性纳米材料由结晶的CaO畴组成,负责观察到的性能增强。实验评价表明,在0.1 M浓度下,0.036 wt.%的富cao纳米颗粒+矿物油(M.O.)混合材料的能耗和功耗最低(0.3832 kWh),这主要是由于导热性增强和摩擦减少。相反,在0.3 M浓度下,纯mo的性能优于纳米润滑油混合物,纳米颗粒团聚增加了粘度,降低了润滑效率。在0.1 M时,0.06 wt.%的富cao纳米颗粒+ M.O.达到最低的压力比,表明最佳的润滑。在0.05 wt.%富cao纳米颗粒+ mo时冷却能力最强(0.3 M)和0.08 wt.%的富cao纳米颗粒+ M.O.(0.1米)。性能系数(COP)在0.05 wt.% (0.3 M)和0.024 wt.% (0.1 M)时达到峰值,强调了纳米颗粒分散在最大化热效率中的重要性。然而,没有一种测试配置满足ISO下拉至-12°C的要求,这突出了深层冷却能力的局限性。关键的新颖之处在于从废旧长春花壳中环保合成富含钙的纳米颗粒,展示了一条通向废物增值和能源效率的途径。与可持续发展目标(sdg) 11.6和13.3相一致,本研究显示了生物衍生纳米润滑剂提高VCRS性能的潜力,最佳纳米颗粒浓度是可持续制冷设计的核心。
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引用次数: 0
Multiscale investigation of EMI shielding performance in carbon black-reinforced epoxy composites 炭黑增强环氧复合材料电磁干扰屏蔽性能的多尺度研究
IF 2 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2026-01-13 DOI: 10.1186/s40712-025-00388-4
Munishamaiah Krishna

This study presents an integrated experimental and analytical investigation of the electromagnetic interference (EMI) shielding effectiveness (SET) of carbon black (CB)-reinforced epoxy composites. Composites were fabricated using a simple hand lay-up technique with CB filler contents ranging from 4 wt.% to 40 wt.%. SET was evaluated in the X-band frequency range (8–12 GHz) using a calibrated Vector Network Analyzer (VNA), relevant to radar, satellite, and wireless communication applications. An analytical model based on classical electromagnetic wave theory was developed to predict total shielding by incorporating reflection, absorption, and multiple internal reflections. Results revealed that absorption dominated the overall shielding response, contributing more than 80–85% of the total attenuation, confirming the material’s suitability for high-frequency EMI suppression. The model showed strong agreement with experimental results, with a mean absolute deviation of 10.16 dB, confirming its validity for preliminary design assessments. Increasing CB content significantly enhanced shielding performance, achieving a maximum SET of 47.48 dB at 25 wt.% representing nearly a 40% improvement relative to low-loading composites. HFSS field simulations further verified strong electromagnetic attenuation and absorption-driven energy dissipation within the composite structure. Minor deviations between model and experiment underscored the importance of uniform filler dispersion. Overall, the findings demonstrate that CB/epoxy composites offer a lightweight, cost-effective, and efficient alternative to traditional metallic EMI shields, providing a rare multiscale correlation across experimental, analytical, and numerical domains.

本文对炭黑(CB)增强环氧复合材料的电磁干扰屏蔽性能进行了综合实验和分析研究。复合材料采用简单的手工铺层技术,CB填料含量为4 wt。%至40% wt.%。SET使用与雷达、卫星和无线通信应用相关的校准矢量网络分析仪(VNA)在x波段频率范围(8-12 GHz)内进行评估。在经典电磁波理论的基础上,建立了综合反射、吸收和多重内反射的全屏蔽预测模型。结果表明,吸收主导了整体屏蔽响应,贡献了超过80-85%的总衰减,证实了材料对高频EMI抑制的适用性。该模型与实验结果吻合较好,平均绝对偏差为10.16 dB,验证了其初步设计评估的有效性。增加CB含量可以显著提高屏蔽性能,在25 wt.%时达到47.48 dB的最大SET,相对于低负载复合材料提高了近40%。HFSS场模拟进一步验证了复合材料结构内部强电磁衰减和吸收驱动的能量耗散。模型和实验之间的微小偏差强调了填料均匀分散的重要性。总体而言,研究结果表明,CB/环氧复合材料提供了一种轻质、经济高效的传统金属电磁干扰屏蔽替代品,在实验、分析和数值领域提供了罕见的多尺度相关性。
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引用次数: 0
In situ observation of metastable phase separation for the development of high-temperature latent heat energy storage materials 亚稳相分离的原位观测用于高温潜热储能材料的开发
IF 2 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2026-01-10 DOI: 10.1186/s40712-025-00398-2
Hidekazu Kobatake, Shunsuke Hayase, Takuya Goto, Yusaku Seimiya, Shumpei Ozawa, Ken-ichi Sugioka, Suguru Shiratori, Tadahiko Masaki, Takehiko Ishikawa

Miscibility gap alloys (MGAs) are promising candidates for high‑temperature thermal energy storage owing to their high latent heat and intrinsic phase separation. In this study, the liquid–liquid phase separation and subsequent solidification of Fe–Cu alloys were experimentally investigated using an aerodynamic levitator in a reducing atmosphere to suppress oxidation. In situ observations using a high-speed camera revealed that Fe‑rich liquid domains separated first from the undercooled homogeneous liquid, followed by the formation of Cu‑rich liquid domains. These observations are consistent with the asymmetry of the Gibbs free energy of mixing in liquid Fe–Cu alloys. The energy densities of these alloys exceeded the upper range of IRENA’s 2050 target (50–85 kWh m⁻3) for high-temperature latent-heat storage at Cu concentrations above 40 at. % (Fe60Cu40 and higher), indicating the potential of Fe–Cu alloys as high‑temperature latent heat storage materials. Our results provide insights into the role of microstructural control and, together with favorable thermal properties, offer a promising strategy for the design of MGA‑based thermal energy storage materials produced by casting.

混相间隙合金具有较高的潜热和本质相分离性,是高温储热材料的理想选择。在本研究中,利用空气动力学悬浮器在还原性气氛中抑制氧化,实验研究了Fe-Cu合金的液-液分离和随后的凝固。利用高速相机进行的现场观测显示,富铁的液体域首先从过冷的均匀液体中分离出来,然后形成富铜的液体域。这些结果与Fe-Cu合金混合过程中吉布斯自由能的不对称性一致。这些合金的能量密度超过了IRENA 2050年目标的上限(50-85 kWh m - 3),用于Cu浓度超过40 at的高温潜热储存。% (Fe60Cu40及更高),表明Fe-Cu合金作为高温潜热储存材料的潜力。我们的研究结果为微观结构控制的作用提供了见解,并与良好的热性能一起,为铸造生产的MGA基储能材料的设计提供了一个有前途的策略。
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引用次数: 0
Restoring welded inconel 625 integrity: a comprehensive multi-technique analysis of optimized post-weld heat treatment 恢复焊接inconel 625的完整性:优化焊后热处理的综合多技术分析
IF 2 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2026-01-09 DOI: 10.1186/s40712-025-00384-8
Khaleel Abushgair, Mike Haddad, Emad Alzubi, Anas Atieh, Mohammad Alshoul

This study examines the impact of post-weld heat treatment (PWHT) on TIG-welded Inconel 625 alloy. Seven TIG welding passes under pure argon shielding gas were utilized to join 10 mm-thick plates prepared with V-groove edge machining. Welded plates were subsequently sectioned into ASTM E8/E8M-compliant dog bone and disc specimens for mechanical testing. The PWHT involved solution annealing at 1060 °C for 2 h followed by rapid quenching, controlled furnace cooling, and a sub-critical temperature soak at 600–800 °C. Mechanical properties were evaluated through tensile testing, pin-on-disc wear tests, and Vickers microhardness measurements. Scanning Electron Microscopy (SEM) and Energy-Dispersive X-ray Spectroscopy (EDX) analyses of the base and fusion zones revealed dissolution of detrimental Laves and δ phases, a homogenized γ-matrix structure, and restored elemental uniformity. However, previous studies have not clearly connected these microstructural changes to the corresponding mechanical and tribological behavior across different weld zones. Heat-treated samples exhibited consistent hardness, maintained tensile strength, improved ductility, and a significant reduction (15%) in friction coefficient. These enhancements confirm the suitability of optimized thermal cycles for restoring solid-solution strengthening and dimensional stability, making the alloy particularly suitable for demanding aerospace and power generation applications exposed to high temperatures and corrosive environments.

本研究考察了焊后热处理(PWHT)对tig焊接Inconel 625合金的影响。采用纯氩气保护下的7道TIG焊道,对采用v型坡口加工的10 mm厚钢板进行了焊接。焊接板随后被分割成符合ASTM E8/ e8m标准的狗骨和椎间盘样本进行力学测试。PWHT包括在1060°C下溶液退火2小时,然后快速淬火,控制炉冷却,以及在600-800°C的亚临界温度浸泡。通过拉伸测试、销盘磨损测试和维氏显微硬度测试来评估机械性能。扫描电镜(SEM)和能量色散x射线能谱(EDX)分析显示,碱基和熔合区有害的Laves和δ相溶解,γ-基体结构均匀化,元素均匀性恢复。然而,之前的研究并没有清楚地将这些微观组织变化与不同焊接区域相应的力学和摩擦学行为联系起来。热处理后的样品表现出一致的硬度,保持抗拉强度,提高延展性,摩擦系数显著降低(15%)。这些增强证实了优化热循环的适用性,以恢复固溶强化和尺寸稳定性,使合金特别适用于苛刻的航空航天和发电应用,暴露在高温和腐蚀性环境中。
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引用次数: 0
Transfer learning for data-efficient modeling of composite metasurface and FSS unit cells 复合超表面和FSS单元胞的数据高效建模迁移学习
IF 2 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2026-01-08 DOI: 10.1186/s40712-025-00392-8
Alexander Wolff, Lukas Mueller, Steffen Klingel, Marco Rahm

This work presents a transfer learning approach for the forward design of composite unit cells of metasurfaces and frequency-selective surfaces (FSS). As a specific application, we target reconfigurable intelligent surfaces (RIS) for wireless communication. We demonstrate that forward models for dual-dipole unit cells can be trained using significantly fewer data by reusing pre-trained models of simpler, single-dipole structures. Our architecture reduces the required training data by up to a factor of 25 while maintaining a mean squared error (MSE) on the order of (10^{-2}). After establishing the forward model for the dual-dipole RIS, we use it in an inverse design framework to synthesize a composite 2-bit RIS unit cell operating at 26.5 GHz. The resulting RIS provides phase modulation in a 270(^circ) range by tuning the reverse bias voltage of integrated varactor diodes. Numerical simulations confirm the validity of the proposed approach, establishing transfer learning as a data-efficient and practical method for the design of composite unit cell structures.

本文提出了一种迁移学习方法,用于超表面和频率选择表面(FSS)复合单元格的正向设计。作为一个特定的应用,我们的目标是无线通信的可重构智能表面(RIS)。我们证明了双偶极子单元细胞的正演模型可以通过重用更简单的单偶极子结构的预训练模型来使用更少的数据进行训练。我们的架构将所需的训练数据减少了25倍,同时保持了(10^{-2})量级的均方误差(MSE)。在建立了双偶极子RIS的正演模型后,我们将其应用于逆设计框架中,合成了一个工作在26.5 GHz的复合2位RIS单元格。由此产生的RIS通过调谐集成变容二极管的反向偏置电压,在270 (^circ)范围内提供相位调制。数值模拟验证了该方法的有效性,证明了迁移学习是一种高效实用的复合材料单胞结构设计方法。
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引用次数: 0
期刊
International Journal of Mechanical and Materials Engineering
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