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27 pages, 6880 KiB  
Article
IgA Nephropathy in Native Kidneys: Oxford and Banff Classifications Reveal Distinct Profiles and Predict Outcomes in Pediatric and Adult Patients
by Danijel Milivojević, Gorana Nikolić, Björn Tampe, Maja Pecić, Snežana Babac, Dušan Paripović, Gordana Miloševski Lomić, Voin Brković, Marko Baralić, Aleksandar Janković, Petar Đurić, Nataša Stajić, Jovana Putnik, Sanja Radojević Škodrić and Maja Životić
Life 2025, 15(8), 1231; https://doi.org/10.3390/life15081231 - 3 Aug 2025
Viewed by 59
Abstract
IgA nephropathy is the most common primary glomerulonephritis, with pathohistological changes described by the Oxford classification, while the Banff classification is used in transplant pathology. This study included 253 patients with IgA nephropathy in native kidneys, divided into the pediatric (n = [...] Read more.
IgA nephropathy is the most common primary glomerulonephritis, with pathohistological changes described by the Oxford classification, while the Banff classification is used in transplant pathology. This study included 253 patients with IgA nephropathy in native kidneys, divided into the pediatric (n = 105) and adult (n = 148) groups. It aimed to examine clinical, and Oxford and Banff morphological parameters in relation to age, correlations of clinical data with pathohistological parameters, and predictors of the disease outcome. Pediatric patients more frequently presented with macroscopic hematuria, while adults showed higher urea and creatinine levels, and lower eGFR. Examining Oxford classification parameters, chronic glomerular and tubulointerstitial lesions were more common in adults. Banff parameters revealed more frequent chronically active glomerular, inflammatory, chronic tubulointerstitial, and vascular lesions in adults. All inflammatory, chronic tubulointerstitial, and vascular parameters correlated with serum urea levels, eGFR and CKD stage in adults, while less frequent in pediatric patients. Tubulointerstitial Oxford and Banff parameters were strong predictors of CKD and proteinuria progression in children, while such predictors were fewer in adults; segmental glomerulosclerosis predicted hematuria progression in adults. Banff parameters (cg, t, ti, i, i-IFTA, ptc, cv), not in Oxford classification, significantly predict outcomes and are recommended for incorporation into IgA nephropathy reports. Full article
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14 pages, 2852 KiB  
Review
Review of Quasi-Solid Aqueous Zinc Batteries: A Bibliometric Analysis
by Zhongxiu Liu, Xiaoou Zhou, Tongyuan Shen, Miaomiao Yu, Liping Zhu, Guiyin Xu and Meifang Zhu
Batteries 2025, 11(8), 293; https://doi.org/10.3390/batteries11080293 - 3 Aug 2025
Viewed by 103
Abstract
Quasi-solid aqueous zinc batteries (QSAZBs) have wide applications in the energy storage field due to their advantages of high safety, cost-effectiveness, and eco-friendliness. Despite prolific research output in the field of QSAZBs, existing reviews predominantly focus on experimental advancements, with limited synthesis of [...] Read more.
Quasi-solid aqueous zinc batteries (QSAZBs) have wide applications in the energy storage field due to their advantages of high safety, cost-effectiveness, and eco-friendliness. Despite prolific research output in the field of QSAZBs, existing reviews predominantly focus on experimental advancements, with limited synthesis of global research trends, interdisciplinary connections, or knowledge gaps. Herein, we review the research on QSAZBs via bibliometric analysis using the VOSviewer software (version 1.6.20). First, the data from qualitatively evaluated publications on QSAZBs from 2016 and 2024 are integrated. In addition, the annual trends, leading countries/regions and their international collaborations, institutional research and patent distribution, and important keyword cluster analyses in QSAZB research are evaluated. The results reveal that China dominates in terms of publication output (71.16% of total papers), and Singapore exhibits the highest citation impact (103.2 citations/paper). International collaboration networks indicate the central role of China, with strong ties to Singapore, the USA, and Australia. Keyword clustering indicates core research priorities: cathode materials (MnO2 and V2O5), quasi-solid electrolyte optimization (hydrogels and graphene composites), and interfacial stability mechanisms. By mapping global trends and interdisciplinary linkages, this work provides insights to accelerate QSAZBs’ transition from laboratory breakthroughs to grid-scale and wearable applications. Full article
(This article belongs to the Special Issue Battery Interface: Analysis & Design)
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25 pages, 8079 KiB  
Article
Electrophoretic Deposition of Green-Synthesized Hydroxyapatite on Thermally Oxidized Titanium: Enhanced Bioactivity and Antibacterial Performance
by Mariana Relva, Daniela Santo, Ricardo Alexandre, Pedro Faia, Sandra Carvalho, Zohra Benzarti and Susana Devesa
Appl. Sci. 2025, 15(15), 8598; https://doi.org/10.3390/app15158598 (registering DOI) - 2 Aug 2025
Viewed by 102
Abstract
Titanium alloys such as Ti-6Al-4V are widely used in biomedical implants due to their excellent mechanical properties and biocompatibility, but their bioinert nature limits osseointegration and antibacterial performance. This study proposes a multifunctional surface coating system integrating a thermally oxidized TiO2 interlayer [...] Read more.
Titanium alloys such as Ti-6Al-4V are widely used in biomedical implants due to their excellent mechanical properties and biocompatibility, but their bioinert nature limits osseointegration and antibacterial performance. This study proposes a multifunctional surface coating system integrating a thermally oxidized TiO2 interlayer with a hydroxyapatite (HAp) top layer synthesized via a green route using Hylocereus undatus extract. The HAp was deposited by electrophoretic deposition (EPD), enabling continuous coverage and strong adhesion to the pre-treated Ti-6Al-4V substrate. Structural, morphological, chemical, and electrical characterizations were performed using XRD, SEM, EDS, Raman spectroscopy, and impedance spectroscopy. Bioactivity was assessed through apatite formation in simulated body fluid (SBF), while antibacterial properties were evaluated against Staphylococcus aureus. The results demonstrated successful formation of crystalline TiO2 (rutile phase) and calcium-rich HAp with good surface coverage. The HAp-coated surfaces exhibited significantly enhanced bioactivity and strong antibacterial performance, likely due to the combined effects of surface roughness and the bioactive compounds present in the plant extract. This study highlights the potential of eco-friendly, bio-inspired surface engineering to improve the biological performance of titanium-based implants. Full article
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21 pages, 14026 KiB  
Article
Development of PEO in Low-Temperature Ternary Nitrate Molten Salt on Ti6V4Al
by Michael Garashchenko, Yuliy Yuferov and Konstantin Borodianskiy
Materials 2025, 18(15), 3603; https://doi.org/10.3390/ma18153603 - 31 Jul 2025
Viewed by 149
Abstract
Titanium alloys are frequently subjected to surface treatments to enhance their biocompatibility and corrosion resistance in biological environments. Plasma electrolytic oxidation (PEO) is an environmentally friendly electrochemical technique capable of forming oxide layers characterized by high corrosion resistance, biocompatibility, and strong adhesion to [...] Read more.
Titanium alloys are frequently subjected to surface treatments to enhance their biocompatibility and corrosion resistance in biological environments. Plasma electrolytic oxidation (PEO) is an environmentally friendly electrochemical technique capable of forming oxide layers characterized by high corrosion resistance, biocompatibility, and strong adhesion to the substrate. In this study, the PEO process was performed using a low-melting-point ternary eutectic electrolyte composed of Ca(NO3)2–NaNO3–KNO3 (41–17–42 wt.%) with the addition of ammonium dihydrogen phosphate (ADP). The use of this electrolyte system enables a reduction in the operating temperature from 280 to 160 °C. The effects of applied voltage from 200 to 400V, current frequency from 50 to 1000 Hz, and ADP concentrations of 0.1, 0.5, 1, 2, and 5 wt.% on the growth of titanium oxide composite coatings on a Ti-6Al-4V substrate were investigated. The incorporation of Ca and P was confirmed by phase and chemical composition analysis, while scanning electron microscopy (SEM) revealed a porous surface morphology typical of PEO coatings. Corrosion resistance in Hank’s solution, evaluated via Tafel plot fitting of potentiodynamic polarization curves, demonstrated a substantial improvement in electrochemical performance of the PEO-treated samples. The corrosion current decreased from 552 to 219 nA/cm2, and the corrosion potential shifted from −102 to 793 mV vs. the Reference Hydrogen Electrode (RHE) compared to the uncoated alloy. These findings indicate optimal PEO processing parameters for producing composite oxide coatings on Ti-6Al-4V alloy surfaces with enhanced corrosion resistance and potential bioactivity, which are attributed to the incorporation of Ca and P into the coating structure. Full article
(This article belongs to the Special Issue Microstructure Engineering of Metals and Alloys, 3rd Edition)
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29 pages, 14906 KiB  
Article
Hydrothermal Engineering of Ferroelectric PZT Thin Films Tailoring Electrical and Ferroelectric Properties via TiO2 and SrTiO3 Interlayers for Advanced MEMS
by Chun-Lin Li and Guo-Hua Feng
Micromachines 2025, 16(8), 879; https://doi.org/10.3390/mi16080879 - 29 Jul 2025
Viewed by 207
Abstract
This work presents an innovative hydrothermal approach for fabricating flexible piezoelectric PZT thin films on 20 μm titanium foil substrates using TiO2 and SrTiO3 (STO) interlayers. Three heterostructures (Ti/PZT, Ti/TiO2/PZT, and Ti/TiO2/STO/PZT) were synthesized to enable low-temperature [...] Read more.
This work presents an innovative hydrothermal approach for fabricating flexible piezoelectric PZT thin films on 20 μm titanium foil substrates using TiO2 and SrTiO3 (STO) interlayers. Three heterostructures (Ti/PZT, Ti/TiO2/PZT, and Ti/TiO2/STO/PZT) were synthesized to enable low-temperature growth and improve ferroelectric performance for advanced flexible MEMS. Characterizations including XRD, PFM, and P–E loop analysis evaluated crystallinity, piezoelectric coefficient d33, and polarization behavior. The results demonstrate that the multilayered Ti/TiO2/STO/PZT structure significantly enhances performance. XRD confirmed the STO buffer layer effectively reduces lattice mismatch with PZT to ~0.76%, promoting stable morphotropic phase boundary (MPB) composition formation. This optimized film exhibited superior piezoelectric and ferroelectric properties, with a high d33 of 113.42 pm/V, representing an ~8.65% increase over unbuffered Ti/PZT samples, and displayed more uniform domain behavior in PFM imaging. Impedance spectroscopy showed the lowest minimum impedance of 8.96 Ω at 10.19 MHz, indicating strong electromechanical coupling. Furthermore, I–V measurements demonstrated significantly suppressed leakage currents in the STO-buffered samples, with current levels ranging from 10−12 A to 10−9 A over ±3 V. This structure also showed excellent fatigue endurance through one million electrical cycles, confirming its mechanical and electrical stability. These findings highlight the potential of this hydrothermally engineered flexible heterostructure for high-performance actuators and sensors in advanced MEMS applications. Full article
(This article belongs to the Special Issue Manufacturing and Application of Advanced Thin-Film-Based Device)
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20 pages, 1399 KiB  
Article
The Impact of COVID-19 on People Living with HIV: A Network Science Perspective
by Jared Christopher, Aiden Nelson, Paris Somerville, Simran Patel and John Matta
COVID 2025, 5(8), 119; https://doi.org/10.3390/covid5080119 - 28 Jul 2025
Viewed by 144
Abstract
People living with HIV (PLWH) faced diverse challenges during the COVID-19 pandemic, including disruptions to care, housing instability, emotional distress, and economic hardship. This study used graph-based clustering methods to analyze pandemic-era experiences of PLWH in a national sample from the NIH’s All [...] Read more.
People living with HIV (PLWH) faced diverse challenges during the COVID-19 pandemic, including disruptions to care, housing instability, emotional distress, and economic hardship. This study used graph-based clustering methods to analyze pandemic-era experiences of PLWH in a national sample from the NIH’s All of Us dataset (n = 242). Across three graph configurations we identified consistent subgroups shaped by social connectedness, housing stability, emotional well-being, and engagement with preventive behaviors. Comparison with an earlier local study of PLWH in Illinois confirmed recurring patterns of vulnerability and resilience while also revealing additional national-level subgroups not observed in the smaller sample. Subgroups with strong social or institutional ties were associated with greater emotional stability and proactive engagement with COVID-19 preventive behaviors, while those facing isolation and structural hardship exhibited elevated distress and limited engagement with COVID-19 preventive measures. These findings underscore the importance of precision public health strategies that reflect the heterogeneity of PLWH and suggest that strengthening social support networks, promoting housing stability, and leveraging institutional connections may enhance pandemic preparedness and HIV care in future public health crises. Full article
(This article belongs to the Section COVID Public Health and Epidemiology)
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29 pages, 6770 KiB  
Article
Machine Learning-Driven Design and Optimization of Multi-Metal Nitride Hard Coatings via Multi-Arc Ion Plating Using Genetic Algorithm and Support Vector Regression
by Yu Gu, Jiayue Wang, Jun Zhang, Yu Zhang, Bushi Dai, Yu Li, Guangchao Liu, Li Bao and Rihuan Lu
Materials 2025, 18(15), 3478; https://doi.org/10.3390/ma18153478 - 24 Jul 2025
Viewed by 258
Abstract
The goal of this study is to develop an efficient machine learning framework for designing high-hardness multi-metal nitride coatings, overcoming the limitations of traditional trial-and-error methods. The development of multicomponent metal nitride hard coatings via multi-arc ion plating remains a significant challenge due [...] Read more.
The goal of this study is to develop an efficient machine learning framework for designing high-hardness multi-metal nitride coatings, overcoming the limitations of traditional trial-and-error methods. The development of multicomponent metal nitride hard coatings via multi-arc ion plating remains a significant challenge due to the vast compositional search space. Although theoretical studies in macroscopic, mesoscopic, and microscopic domains exist, these often focus on idealized models and lack effective coupling across scales, leading to time-consuming and labor-intensive traditional methods. With advancements in materials genomics and data mining, machine learning has become a powerful tool in material discovery. In this work, we construct a compositional search space for multicomponent nitrides based on electronic configuration, valence electron count, electronegativity, and oxidation states of metal elements in unary nitrides. The search space is further constrained by FCC crystal structure and hardness theory. By incorporating a feature library with micro-, meso-, and macro-structural characteristics and using clustering analysis with theoretical intermediate variables, the model enriches dataset information and enhances predictive accuracy by reducing experimental errors. This model is successfully applied to design multicomponent metal nitride coatings using a literature-derived database of 233 entries. Experimental validation confirms the model’s predictions, and clustering is used to minimize experimental and data errors, yielding a strong agreement between predicted optimal molar ratios of metal elements and nitrogen and measured hardness performance. Of the 100 Vickers hardness (HV) predictions made by the model using input features like molar ratios of metal elements (e.g., Ti, Al, Cr, Zr) and atomic size mismatch, 82 exceeded the dataset’s maximum hardness, with the best sample achieving a prediction accuracy of 91.6% validated against experimental measurements. This approach offers a robust strategy for designing high-performance coatings with optimized hardness. Full article
(This article belongs to the Special Issue Advances in Computation and Modeling of Materials Mechanics)
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39 pages, 13464 KiB  
Article
Micro-Doppler Signal Features of Idling Vehicle Vibrations: Dependence on Gear Engagements and Occupancy
by Ram M. Narayanan, Benjamin D. Simone, Daniel K. Watson, Karl M. Reichard and Kyle A. Gallagher
Signals 2025, 6(3), 35; https://doi.org/10.3390/signals6030035 - 24 Jul 2025
Viewed by 354
Abstract
This study investigates the use of a custom-built 10 GHz continuous wave micro-Doppler radar system to analyze external vibrations of idling vehicles under various conditions. Scenarios included different gear engagements with one occupant and parked gear with up to four occupants. Motivated by [...] Read more.
This study investigates the use of a custom-built 10 GHz continuous wave micro-Doppler radar system to analyze external vibrations of idling vehicles under various conditions. Scenarios included different gear engagements with one occupant and parked gear with up to four occupants. Motivated by security concerns, such as the threat posed by idling vehicles with multiple occupants, the research explores how micro-Doppler signatures can indicate vehicle readiness to move. Experiments focused on a mid-size SUV, with similar trends seen in other vehicles. Radar data were compared to in situ accelerometer measurements, confirming that the radar system can detect subtle frequency changes, especially during gear shifts. The system’s sensitivity enables it to distinguish variations tied to gear state and passenger load. Extracted features like frequency and magnitude show strong potential for use in machine learning models, offering a non-invasive, remote sensing method for reliably identifying vehicle operational states and occupancy levels in security or monitoring contexts. Spectrogram and PSD analyses reveal consistent tonal vibrations around 30 Hz, tied to engine activity, with harmonics at 60 Hz and 90 Hz. Gear shifts produce impulse signatures primarily below 20 Hz, and transient data show distinct peaks at 50, 80, and 100 Hz. Key features at 23 Hz and 45 Hz effectively indicate engine and gear states. Radar and accelerometer data align well, supporting the potential for remote sensing and machine learning-based classification. Full article
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20 pages, 958 KiB  
Article
Perspectives of Refugees from Ukraine on Cultural Identity and Health Care Experiences During U.S. Resettlement
by Marianne R. Choufani, Kim L. Larson and Marina Y. Prannik
Nurs. Rep. 2025, 15(7), 263; https://doi.org/10.3390/nursrep15070263 - 18 Jul 2025
Viewed by 347
Abstract
Background: More than three years have elapsed since the onset of the full-scale invasion of Ukraine by the Russian Federation, displacing millions of Ukrainians. While preserving cultural identity in the host country is important for gaining resilience among refugees, we found no studies [...] Read more.
Background: More than three years have elapsed since the onset of the full-scale invasion of Ukraine by the Russian Federation, displacing millions of Ukrainians. While preserving cultural identity in the host country is important for gaining resilience among refugees, we found no studies about how cultural identity influences health care experiences during resettlement. Objective: This study explores how cultural identity shapes health care experiences among Ukrainian refugees during resettlement in the United States. Methods: We conducted an interpretive description study using focus groups to elicit the perspectives of Ukrainian refugees who resettled in North Carolina after 24 February 2022. Twelve Ukrainian women participated in one of four focus groups. Thematic content analysis was employed for case comparison, and themes were inductively derived. Results: Two themes were identified: troubled health care partnerships and imprecise notions of preventive practices. Troubled partnerships represented a lack of trust between refugees and U.S. clinicians and the health care system. Imprecise notions of preventive practices represented mistaken beliefs about prevention. Conclusions: This study adds to the science on refugee health in two ways. First, newly arrived refugees often maintain strong ties to their homeland, which shapes their health care decisions and reinforces their cultural identity. Second, despite being well educated, some refugees held misconceptions about preventive health care, highlighting the need for clinicians to provide clear guidance on primary and secondary prevention practices. Findings may help guide clinicians in delivering culturally sensitive care to refugee populations. Full article
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23 pages, 25056 KiB  
Article
Mineral Chemistry and Whole-Rock Analysis of Magnesian and Ferroan Granitic Suites of Magal Gebreel, South Eastern Desert: Clues for Neoproterozoic Syn- and Post-Collisional Felsic Magmatism
by El Saeed R. Lasheen, Gehad M. Saleh, Amira El-Tohamy, Farrage M. Khaleal, Mabrouk Sami, Ioan V. Sanislav and Fathy Abdalla
Minerals 2025, 15(7), 751; https://doi.org/10.3390/min15070751 - 17 Jul 2025
Viewed by 387
Abstract
The article provides a comprehensive analysis of the Magal Gebreel granitic suites (MGGs) using petrological (fieldwork, petrography, mineral chemistry, and bulk rock analysis) aspects to infer their petrogenesis and emplacement setting. Our understanding of the development of the northern portion of the Arabian [...] Read more.
The article provides a comprehensive analysis of the Magal Gebreel granitic suites (MGGs) using petrological (fieldwork, petrography, mineral chemistry, and bulk rock analysis) aspects to infer their petrogenesis and emplacement setting. Our understanding of the development of the northern portion of the Arabian Nubian Shield is significantly improved by the Neoproterozoic granitic rocks of the seldom studied MGGs in Egypt’s south Eastern Desert. According to detailed field, mineralogical, and geochemical assessments, they comprise syn-collision (granodiorites) and post-collision (monzogranites, syenogranites, and alkali feldspar rocks). Granodiorite has strong positive Pb, notable negative P, Ti, and Nb anomalies, and is magnesian in composition. They have high content of LREEs (light rare-earth elements) compared to HREEs (heavy rare-earth elements) and clear elevation of LFSEs (low-field strength elements; K Rb, and Ba) compared to HFSEs (high-field strength elements; Zr and Nb), which are in accord with the contents of I-type granites from the Eastern Desert. In this context, the granodiorites are indicative of an early magmatic phase that probably resulted from the partial melting of high K-mafic sources in the subduction zone. Conversely, the post-collision rocks have low contents of Mg#, CaO, P2O5, MgO, Fe2O3, Sr, and Ti, and high SiO2, Fe2O3/MgO, Nb, Ce, and Ga/Al, suggesting A-type features with ferroan affinity. Their P, Nb, Sr, Ba, and Ti negative anomalies are in accord with the findings for Eastern Desert granites of the A2-type. Furthermore, they exhibit a prominent negative anomaly in Eu and a small elevation of LREEs in relation to HREEs. The oxygen fugacity (fO2) for the rocks under investigation can be calculated using the biotite chemistry. The narrow Fe/(Fe + Mg) ratio range (0.6–0.75) indicates that they crystallized under moderately oxidizing conditions between ~QFM +0.1 and QFM +1. The A-type rocks were formed by the partial melting of a tonalite source (underplating rocks) in a post-collisional environment during the late period of extension via slab delamination. The lithosphere became somewhat impregnated with particular elements as a result of the interaction between the deeper crust and the upwelling mantle. Full article
(This article belongs to the Section Mineral Geochemistry and Geochronology)
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15 pages, 4749 KiB  
Article
Selective Laser Melting of a Ti-6Al-4V Lattice-Structure Gear: Design, Topology Optimization, and Experimental Validation
by Riad Ramadani, Snehashis Pal, Aleš Belšak and Jožef Predan
Appl. Sci. 2025, 15(14), 7949; https://doi.org/10.3390/app15147949 - 17 Jul 2025
Viewed by 337
Abstract
The manufacture of lightweight components is one of the most important requirements in the automotive and aerospace industries. Gears, on the other hand, are among the heaviest parts in terms of their total weight. Accordingly, a spur gear was considered, the body of [...] Read more.
The manufacture of lightweight components is one of the most important requirements in the automotive and aerospace industries. Gears, on the other hand, are among the heaviest parts in terms of their total weight. Accordingly, a spur gear was considered, the body of which was configured as a lattice structure to make it lightweight. In addition, the structure was optimized by topology optimization using ProTOP software. Subsequently, the gear was manufactured by a selective laser melting process by using a strong and lightweight material, namely Ti-6Al-4V. This study defeated the problems of manufacturing orientation, surface roughness, support structure, and bending due to the high thermal gradient in the selective laser melting process. To experimentally investigate the benefits of such a lightweight gear body structure, a new test rig with a closed loop was developed. This rig enabled measurements of strains in the gear ring, hub, and tooth root. The experimental results confirmed that a specifically designed and selectively laser-melted, lightweight cellular lattice structure in the gear body can significantly influence strain. This is especially significant with respect to strain levels and their time-dependent variations in the hub section of the gear body. Full article
(This article belongs to the Section Additive Manufacturing Technologies)
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13 pages, 4656 KiB  
Article
High-Speed and Hysteresis-Free Near-Infrared Optical Hydrogen Sensor Based on Ti/Pd Bilayer Thin Films
by Ashwin Thapa Magar, Tu Anh Ngo, Hoang Mai Luong, Thi Thu Trinh Phan, Minh Tuan Trinh, Yiping Zhao and Tho Duc Nguyen
Nanomaterials 2025, 15(14), 1105; https://doi.org/10.3390/nano15141105 - 16 Jul 2025
Viewed by 496
Abstract
Palladium (Pd) and titanium (Ti) exhibit opposite dielectric responses upon hydrogenation, with stronger effects observed in the near-infrared (NIR) region. Leveraging this contrast, we investigated Ti/Pd bilayer thin films as a platform for NIR hydrogen sensing—particularly at telecommunication-relevant wavelengths, where such devices have [...] Read more.
Palladium (Pd) and titanium (Ti) exhibit opposite dielectric responses upon hydrogenation, with stronger effects observed in the near-infrared (NIR) region. Leveraging this contrast, we investigated Ti/Pd bilayer thin films as a platform for NIR hydrogen sensing—particularly at telecommunication-relevant wavelengths, where such devices have remained largely unexplored. Ti/Pd bilayers coated with Teflon AF (TAF) and fabricated via sequential electron-beam and thermal evaporation were characterized using optical transmission measurements under repeated hydrogenation cycles. The Ti (5 nm)/Pd (x = 2.5 nm)/TAF (30 nm) architecture showed a 2.7-fold enhancement in the hydrogen-induced optical contrast at 1550 nm compared to Pd/TAF reference films, attributed to the hydrogen ion exchange between the Ti and Pd layers. The optimized structure, with a Pd thickness of x = 1.9 nm, exhibited hysteresis-free sensing behavior, a rapid response time (t90 < 0.35 s at 4% H2), and a detection limit below 10 ppm. It also demonstrated excellent selectivity with negligible cross-sensitivity to CO2, CH4, and CO, as well as high durability, showing less than 6% signal degradation over 135 hydrogenation cycles. These findings establish a scalable, room-temperature NIR hydrogen sensing platform with strong potential for deployment in automotive, environmental, and industrial applications. Full article
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21 pages, 7349 KiB  
Article
Effect of Ti Doping of Al0.7CoCrFeNi-Based High Entropy Alloys on Their Erosion Resistance by Solid Particles
by Wojciech J. Nowak, Tadeusz Kubaszek, Andrzej Gradzik, Małgorzata Grądzka-Dahlke, Dariusz Perkowski, Marzena Tokarewicz, Mariusz Walczak and Mirosław Szala
Materials 2025, 18(14), 3328; https://doi.org/10.3390/ma18143328 - 15 Jul 2025
Viewed by 253
Abstract
The erosion resistance of materials against solid particles is a very important property, especially in the transportation of powders or in aeronautics (dust inside jet engines). There is a strong need to introduce new materials that have higher solid particle erosion resistance than [...] Read more.
The erosion resistance of materials against solid particles is a very important property, especially in the transportation of powders or in aeronautics (dust inside jet engines). There is a strong need to introduce new materials that have higher solid particle erosion resistance than state-of-the-art materials. Thus, in the present work, the solid erosion particles of high entropy alloys (HEAs) based on the Al0.7CoCrFeNi matrix were studied compared to the state-of-the-art stainless steel AISI 304. Furthermore, the effect of the addition of Ti to HEAs on hardness and erosion resistance was investigated. Current research included the development of the chemical composition of a new kind of HEA designed on the basis of thermodynamical calculations performed in CALPHAD, its manufacturing, full characterization involving microstructural and phase analyses, hardness measurements, solid particle erosion tests, and finally, the elucidation of erosion mechanisms. It was found that HEAs showed higher hardness as well as erosion resistance than AISI 304. Moreover, it was found that the increase in Ti content in an HEA resulted in an increase in the hardness and resistance to the erosion of the studied HEA. As the main reason for this phenomenon, the stabilization of the β-BCC phase, suppression of the α-FCC phase, and the appearance of the Ni3Ti phase in the studied HEA were claimed. Full article
(This article belongs to the Special Issue New Advances in High Entropy Alloys)
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23 pages, 4276 KiB  
Article
First-Principles Insights into Mo and Chalcogen Dopant Positions in Anatase, TiO2
by W. A. Chapa Pamodani Wanniarachchi, Ponniah Vajeeston, Talal Rahman and Dhayalan Velauthapillai
Computation 2025, 13(7), 170; https://doi.org/10.3390/computation13070170 - 14 Jul 2025
Viewed by 242
Abstract
This study employs density functional theory (DFT) to investigate the electronic and optical properties of molybdenum (Mo) and chalcogen (S, Se, Te) co-doped anatase TiO2. Two co-doping configurations were examined: Model 1, where the dopants are adjacent, and Model 2, where [...] Read more.
This study employs density functional theory (DFT) to investigate the electronic and optical properties of molybdenum (Mo) and chalcogen (S, Se, Te) co-doped anatase TiO2. Two co-doping configurations were examined: Model 1, where the dopants are adjacent, and Model 2, where the dopants are farther apart. The incorporation of Mo into anatase TiO2 resulted in a significant bandgap reduction, lowering it from 3.22 eV (pure TiO2) to range of 2.52–0.68 eV, depending on the specific doping model. The introduction of Mo-4d states below the conduction band led to a shift in the Fermi level from the top of the valence band to the bottom of the conduction band, confirming the n-type doping characteristics of Mo in TiO2. Chalcogen doping introduced isolated electronic states from Te-5p, S-3p, and Se-4p located above the valence band maximum, further reducing the bandgap. Among the examined configurations, Mo–S co-doping in Model 1 exhibited most optimal structural stability structure with the fewer impurity states, enhancing photocatalytic efficiency by reducing charge recombination. With the exception of Mo–Te co-doping, all co-doped systems demonstrated strong oxidation power under visible light, making Mo-S and Mo-Se co-doped TiO2 promising candidates for oxidation-driven photocatalysis. However, their limited reduction ability suggests they may be less suitable for water-splitting applications. The study also revealed that dopant positioning significantly influences charge transfer and optoelectronic properties. Model 1 favored localized electron density and weaker magnetization, while Model 2 exhibited delocalized charge density and stronger magnetization. These findings underscore the critical role of dopant arrangement in optimizing TiO2-based photocatalysts for solar energy applications. Full article
(This article belongs to the Special Issue Feature Papers in Computational Chemistry)
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24 pages, 7332 KiB  
Article
High-Performance Natural Dye-Sensitized Solar Cells Employing a New Semiconductor: Gd2Ru2O7 Pyrochlore Oxide
by Assohoun F. Kraidy, Abé S. Yapi, Joseph K. Datte, Michel Voue, Mimoun El Marssi, Anthony Ferri and Yaovi Gagou
Condens. Matter 2025, 10(3), 38; https://doi.org/10.3390/condmat10030038 - 14 Jul 2025
Viewed by 623
Abstract
We investigated a novel natural dye-sensitized solar cell (DSSC) utilizing gadolinium ruthenate pyrochlore oxide Gd2Ru2O7 (GRO) as a photoanode and compared its performance to the TiO2-Gd2Ru2O7 (TGRO) combined-layer configuration. The films [...] Read more.
We investigated a novel natural dye-sensitized solar cell (DSSC) utilizing gadolinium ruthenate pyrochlore oxide Gd2Ru2O7 (GRO) as a photoanode and compared its performance to the TiO2-Gd2Ru2O7 (TGRO) combined-layer configuration. The films were fabricated using the spin-coating technique, resulting in spherical grains with an estimated mean diameter of 0.2 µm, as observed via scanning electron microscopy (SEM). This innovative photoactive gadolinium ruthenate pyrochlore oxide demonstrated strong absorption in the visible range and excellent dye adhesion after just one hour of exposure to natural dye. X-ray diffraction confirmed the presence of the pyrochlore phase, where Raman spectroscopy identified various vibration modes characteristic of the pyrochlore structure. Incorporating Gd2Ru2O7 as the photoanode significantly enhanced the overall efficiency of the DSSCs. The device configuration FTO/compact-layer/Gd2Ru2O7/Hibiscus-sabdariffa/electrolyte(I/I3)/Pt achieved a high efficiency of 9.65%, an open-circuit voltage (Voc) of approximately 3.82 V, and a current density of 4.35 mA/cm2 for an active surface area of 0.38 cm2. A mesoporous TiO2-based DSSC was fabricated under the same conditions for comparison. Using impedance spectroscopy and cyclic voltammetry measurements, we provided evidence of the mechanism of conductivity and the charge carrier’s contribution or defect contributions in the DSSC cells to explain the obtained Voc value. Through cyclic voltammetry measurements, we highlight the redox activities of hibiscus dye and electrolyte (I/I3), which confirmed electrochemical processes in addition to a photovoltaic response. The high and unusual obtained Voc value was also attributed to the presence in the photoanode of active dipoles, the layer thickness, dye concentration, and the nature of the electrolyte. Full article
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