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Keywords = lattice strain

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19 pages, 10374 KiB  
Article
Nanoscale Nickel Oxide: Synthesis, Characterization, and Impact on Antibacterial Activity Against Representative Microorganisms
by Daniela Istrate, Mihai Oproescu, Ecaterina Magdalena Modan, Sorin Georgian Moga, Denis Aurelian Negrea and Adriana-Gabriela Schiopu
ChemEngineering 2025, 9(4), 77; https://doi.org/10.3390/chemengineering9040077 - 25 Jul 2025
Viewed by 185
Abstract
Among the various available synthesis approaches, hydrolytic precipitation offers a simple, cost-effective, and scalable route for producing phase-pure NiO with a controlled morphology and crystallite size. However, the influence of calcination temperature on its crystalline phase, particle size, and antimicrobial activity remains an [...] Read more.
Among the various available synthesis approaches, hydrolytic precipitation offers a simple, cost-effective, and scalable route for producing phase-pure NiO with a controlled morphology and crystallite size. However, the influence of calcination temperature on its crystalline phase, particle size, and antimicrobial activity remains an active field of research. This study aims to investigate the structural, morphological, and antibacterial properties of NiO nanoparticles synthesized via hydrolytic methods and thermally treated at different temperatures. XRD data indicate the presence of the hexagonal crystallographic phase of NiO (space group 166: R-3m), a structural variant less commonly reported in the literature, stabilized under mild hydrolytic synthesis conditions. The average crystallite size increases significantly from 4.97 nm at 300 °C to values of ~17.8 nm at 500–700 °C, confirming the development of the crystal lattice. The ATR-FTIR analysis confirms the presence of the characteristic Ni–O band for all samples, positioned between 367 and 383 cm−1, with a reference value of 355 cm−1 for commercial NiO. The displacements and variations in intensity reflect a thermal evolution of the crystalline structure, but also an important influence of the size of the crystallites and the agglomeration state. The results reveal a systematic evolution in particle morphology from porous, flake-like nanostructures at 300 °C to dense, well-faceted polyhedral crystals at 900 °C. With an increasing temperature, particle size increases. EDS spectra confirm the high purity of the NiO phase across all samples. Additionally, the NiO nanoparticles exhibit calcination-temperature-dependent antibacterial activity, with the complete inhibition of Escherichia coli and Enterococcus faecalis observed after 24 h for the sample calcined at 300 °C and over 90% CFU reduction within 4 h. A significant reduction in E. faecalis viability across all samples indicates time- and strain-specific bactericidal effects. Due to its remarkable multifunctionality, NiO has emerged as a strategic nanomaterial in fields ranging from energy storage and catalysis to antimicrobial technologies, where precise control over its structural phase and particle size is essential for optimizing performance. Full article
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20 pages, 3323 KiB  
Review
The Structural Regulation and Properties of Energetic Materials: A Review
by Jin Yu, Siyu Xu, Weiqiang Pang, Hanyu Jiang and Zihao Zhang
Nanomaterials 2025, 15(15), 1140; https://doi.org/10.3390/nano15151140 - 23 Jul 2025
Viewed by 328
Abstract
Structural regulation is of great significance for improving the comprehensive performance of energetic materials (EMs). The structural regulation and properties of EMs were summarized. For single-component EMs, particle size control focuses on quality consistency and industrial scalability, morphology modification mainly improves sphericity through [...] Read more.
Structural regulation is of great significance for improving the comprehensive performance of energetic materials (EMs). The structural regulation and properties of EMs were summarized. For single-component EMs, particle size control focuses on quality consistency and industrial scalability, morphology modification mainly improves sphericity through monomers or aggregates and explores the possibility of layered energetic materials in improving mechanical properties, and polycrystalline regulation suppresses metastable phases and explores novel crystalline forms using simulation-guided design. Composite EMs (CEMs) employ core–shell structures to balance safety with performance via advanced coating materials, cocrystal engineering to tailor energy release through intermolecular interactions, and lattice strain modulation, and mixing structures integrates component advantages while enhancing the reaction efficiency. Future directions emphasize computational simulations and novel fabrication methods to guide the rational design and precise preparation of next-generation EMs with specific functions. Full article
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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 318
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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19 pages, 11950 KiB  
Article
Enhancing Tensile Performance of Cemented Tailings Backfill Through 3D-Printed Polymer Lattices: Mechanical Properties and Microstructural Investigation
by Junzhou Huang, Lan Deng, Haotian Gao, Cai Wu, Juan Li and Daopei Zhu
Materials 2025, 18(14), 3314; https://doi.org/10.3390/ma18143314 - 14 Jul 2025
Viewed by 278
Abstract
This study presents an innovative solution to improve the mechanical performance of traditional cemented tailings backfill (CTB) by incorporating 3D-printed polymer lattice (3DPPL) reinforcements. We systematically investigated three distinct 3DPPL configurations (four-column FC, six-column SC, and cross-shaped CO) through comprehensive experimental methods including [...] Read more.
This study presents an innovative solution to improve the mechanical performance of traditional cemented tailings backfill (CTB) by incorporating 3D-printed polymer lattice (3DPPL) reinforcements. We systematically investigated three distinct 3DPPL configurations (four-column FC, six-column SC, and cross-shaped CO) through comprehensive experimental methods including Brazilian splitting tests, digital image correlation (DIC), and scanning electron microscopy (SEM). The results show that the 3DPPL reinforcement significantly enhances the CTB’s tensile properties, with the CO structure demonstrating the most substantial improvement—increasing the tensile strength by 85.6% (to 0.386 MPa) at a cement-to-tailings ratio of 1:8. The 3DPPL-modified CTB exhibited superior ductility and progressive failure characteristics, as evidenced by multi-stage load-deflection behavior and a significantly higher strain capacity (41.698–51.765%) compared to unreinforced specimens (2.504–4.841%). The reinforcement mechanism involved synergistic effects of macroscopic truss behavior and microscopic interfacial bonding, which effectively redistributed the stress and dissipated energy. This multi-scale approach successfully transforms CTB’s failure mode from brittle to progressive while optimizing both strength and toughness, providing a promising advancement for mine backfill material design. Full article
(This article belongs to the Section Mechanics of Materials)
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16 pages, 2819 KiB  
Article
High-Strain-Rate Deformation Behavior and Damage Mechanisms of Ti/Al Interpenetrating Phase Composites
by Zhou Li, Zhongli Zhang, Jiahao Tian, Junhao Li, Shiqi Xia, Libo Zhou and Long Yu
Processes 2025, 13(7), 2234; https://doi.org/10.3390/pr13072234 - 12 Jul 2025
Viewed by 370
Abstract
Interpenetrating phase composites (IPCs) have demonstrated tremendous potential across various fields, particularly those based on triply periodic minimal surface (TPMS) structures, whose uniquely interwoven lattice architectures have attracted widespread attention. However, current research on the dynamic mechanical properties of such IPC remains limited, [...] Read more.
Interpenetrating phase composites (IPCs) have demonstrated tremendous potential across various fields, particularly those based on triply periodic minimal surface (TPMS) structures, whose uniquely interwoven lattice architectures have attracted widespread attention. However, current research on the dynamic mechanical properties of such IPC remains limited, and their impact resistance and damage mechanisms are yet to be thoroughly understood. In this study, a novel design of two volume fractions of IPCs based on the TPMS IWP configuration is developed using Python-based parametric modeling, with the Ti6Al4V alloy TPMS scaffolds fabricated via selective laser melting (SLM) and the AlSi12 reinforcing phase through infiltration casting. The influence of Ti alloy volume fraction and strain rate on the dynamic mechanical behavior of the Ti/Al IPC is systematically investigated using a split Hopkinson pressure bar (SHPB) experimental setup. Microscopic characterization validates the effectiveness and reliability of the proposed IPC fabrication method. Results show that the increasing Ti alloy volume fraction significantly affects the dynamic mechanical properties of the IPC, and IPCs with different Ti alloy volume fractions exhibit contrasting mechanical behaviors under increasing strain rates, attributed to the dominance of different constituent phases. This study enhances the understanding of the dynamic behavior of TPMS-based IPCs and offers a promising route for the development of high-performance energy-absorbing materials. Full article
(This article belongs to the Section Manufacturing Processes and Systems)
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14 pages, 1694 KiB  
Article
Elastic to Plastic Lattice Structure Homogenization via Finite Element Limit Analysis
by Renato Zona and Vincenzo Minutolo
Symmetry 2025, 17(7), 1120; https://doi.org/10.3390/sym17071120 - 12 Jul 2025
Viewed by 234
Abstract
This work focuses on characterizing structured metamaterials by assessing their elastic law and ultimate strength using finite elements and limit analysis applied to a representative volume element. The elastic and plastic behavior of a reference geometry—the octet truss lattice—is obtained by calculating the [...] Read more.
This work focuses on characterizing structured metamaterials by assessing their elastic law and ultimate strength using finite elements and limit analysis applied to a representative volume element. The elastic and plastic behavior of a reference geometry—the octet truss lattice—is obtained by calculating the response of the representative volume element subjected to prescribed tensor strain bases, namely pure normal strain and pure shear, along the cube symmetry directions. The geometry of the body centered cubic and pure cubic phases of the representative volume element has been analyzed, highlighting that the elastic isotropic behavior depends on the ratio between the stiffnesses of the two phases. The ultimate behavior of the structure has been analyzed through the direct application of the lower bound method of limit analysis. The method has been implemented in a direct finite element environment using the limit analysis procedure developed by the authors. The method was already used and described in previous publications and is briefly recalled. It is based on the identification of the linear operator linking the self-equilibrated stress set to a discrete parameter manifold, accounting for the piecewise continuous distribution of the permanent strain. In the paper, it is highlighted that for different aspect ratios between the body-centered cubic and the pure cubic phase geometry, different ratios between limit shear stress and normal stress arise, the isotropic one assumed to coincide with the von Mises result, where σ0τ0=3. Full article
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20 pages, 13368 KiB  
Article
Influence of Soaking Duration in Deep Cryogenic and Heat Treatment on the Microstructure and Properties of Copper
by Dhandapani Chirenjeevi Narashimhan and Sanjivi Arul
J. Manuf. Mater. Process. 2025, 9(7), 233; https://doi.org/10.3390/jmmp9070233 - 7 Jul 2025
Viewed by 318
Abstract
The extensive use of copper in thermal and electrical systems calls for constant performance enhancement by means of innovative material treatments. The effects on the microstructural, mechanical, and electrical characteristics of copper in deep cryogenic treatment (DCT) and deep cryogenic treatment followed by [...] Read more.
The extensive use of copper in thermal and electrical systems calls for constant performance enhancement by means of innovative material treatments. The effects on the microstructural, mechanical, and electrical characteristics of copper in deep cryogenic treatment (DCT) and deep cryogenic treatment followed by heat treatment (DCT + HT) are investigated in this work. Copper samples were treated for various soaking durations ranging from 6 to 24 h. Mechanical properties such as tensile strength, hardness, and wear rate were analyzed. In the DCT-treated samples, tensile strength increased, reaching a peak of 343 MPa at 18 h, alongside increased hardness (128 HV) and a refined grain size of 9.58 µm, primarily due to elevated dislocation density and microstrain. At 18 h of soaking, DCT + HT resulted in improved structural stability, high hardness (149 HV), a fine grain size (7.42 µm), and the lowest wear rate (7.73 × 10−10 mm3/Nm), consistent with Hall–Petch strengthening. Electrical measurements revealed improved electron mobility (52.08 cm2/V·s) for samples soaked for 24 h in DCT + HT, attributed to increased crystallite size (39.9 nm), reduced lattice strain, and higher (111) texture intensity. SEM–EBSD analysis showed a substantial increase in low-angle grain boundaries (LAGBs) in DCT + HT-treated samples, correlating with enhanced electrical conductivity. Overall, an 18 h soaking duration was found to be optimal for both treatments. However, the strengthening mechanism in DCT + HT is influenced by grain boundary stabilization and thermal recovery and is different to DCT, which is strain-induced enhancement. Full article
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14 pages, 1125 KiB  
Article
Influence of Heat Treatment Temperature on Microstructure and Mechanical Properties of TiB2@Ti/AlCoCrFeNi2.1 Eutectic High-Entropy Alloy Matrix Composites
by Fuqiang Guo, Yajun Zhou, Qinggang Jiang, Panfeng Chen and Bo Ren
Metals 2025, 15(7), 757; https://doi.org/10.3390/met15070757 - 5 Jul 2025
Viewed by 304
Abstract
This study systematically investigates the effects of heat treatment at 800–1000 °C on the microstructure and mechanical properties of 10 wt.% TiB2@Ti/AlCoCrFeNi2.1 eutectic high-entropy alloy matrix composites (EHEAMCs) prepared by vacuum hot-pressing sintering. The results show that the materials consist [...] Read more.
This study systematically investigates the effects of heat treatment at 800–1000 °C on the microstructure and mechanical properties of 10 wt.% TiB2@Ti/AlCoCrFeNi2.1 eutectic high-entropy alloy matrix composites (EHEAMCs) prepared by vacuum hot-pressing sintering. The results show that the materials consist of FCC, BCC, TiB2, and Ti phases, with a preferred orientation of the (111) crystal plane of the FCC phase. As the temperature increases, the diffraction peak of the BCC phase separates from the main FCC peak and its intensity increases, while the diffraction peak positions of the FCC and BCC phases shift at small angles. This is attributed to the diffusion of TiB2@Ti from the grain boundaries into the matrix, where the Ti solid solution increases the lattice constant of the FCC phase. Microstructural observations reveal that the eutectic region transforms from lamellar to island-like structures, and the solid solution zone narrows. With increasing temperature, the Ti concentration in the solid solution zone increases, while the contents of elements such as Ni decrease. Element diffusion is influenced by binary mixing enthalpy, with Ti and B tending to solidify in the FCC and BCC phase regions, respectively. The mechanical properties improve with increasing temperature. At 1000 °C, the average hardness is 579.2 HV, the yield strength is 1294 MPa, the fracture strength is 2385 MPa, and the fracture strain is 19.4%, representing improvements of 35.5% and 24.9% compared to the as-sintered state, respectively, without loss of plasticity. The strengthening mechanisms include enhanced solid solution strengthening due to the diffusion of Ti and TiB2, improved grain boundary strength due to the diffusion of alloy elements to the grain boundaries, and synergistic optimization of strength and plasticity. Full article
(This article belongs to the Special Issue Feature Papers in Entropic Alloys and Meta-Metals)
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14 pages, 2125 KiB  
Article
A Theoretical Analysis of the Frequency Response in p-i-n Photodiodes that Use InGaAs/InP Materials
by Nesrine Bakalem, Abdelkader Aissat, Samuel Dupont, Faouzi Saidi, Mohamed Houcine Dhaou and Jean Pierre Vilcot
Micromachines 2025, 16(7), 764; https://doi.org/10.3390/mi16070764 - 29 Jun 2025
Viewed by 382
Abstract
This investigation is centered on the analysis of frequency response characteristics of a p-i-n photodiode using InxGa1−xAs/InP. The InGaAs/InP can be developed under three conditions: compression, tensile strain, and lattice matching. Initially, we performed calculations on strain, bandgap energy (Eg [...] Read more.
This investigation is centered on the analysis of frequency response characteristics of a p-i-n photodiode using InxGa1−xAs/InP. The InGaAs/InP can be developed under three conditions: compression, tensile strain, and lattice matching. Initially, we performed calculations on strain, bandgap energy (Eg), and absorption coefficient. We then optimized the influence of indium concentration (x) on stability, critical thickness, bandgap energy, and absorption coefficient. The effects of temperature and deformation on Eg were also studied. Finally, we optimized the cutoff frequency (fc), capacitive effects, and response frequency by considering the impact of x, active layer thickness (d), and surface area (S). For our future endeavors, we intend to explore additional parameters that may affect the p-i-n response. In future work, we can add transparent double layers in the i. InGaAs layer to reduce the transit time, leading to the development of an ultrafast photodiode. Full article
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16 pages, 1205 KiB  
Article
Theoretical Prediction of the Impact of Phosphorus Doping on the Elastic Constants of Silicon
by Azadeh Jafari and Behraad Bahreyni
Micromachines 2025, 16(7), 748; https://doi.org/10.3390/mi16070748 - 25 Jun 2025
Viewed by 535
Abstract
Accurately controlling the mechanical properties of silicon is essential for developing high-performance micro-devices and systems. In this study, we investigate the influence of phosphorus doping on the elastic constants of silicon across a wide temperature range using a combination of tight-binding simulations and [...] Read more.
Accurately controlling the mechanical properties of silicon is essential for developing high-performance micro-devices and systems. In this study, we investigate the influence of phosphorus doping on the elastic constants of silicon across a wide temperature range using a combination of tight-binding simulations and deformation potential theory. The mechanical properties were derived using Keyes’s framework integrated with Fermi–Dirac statistics. The Goodwin–Skinner–Pettifor functional form was applied to estimate dopant-induced stress potentials and their effect on lattice stiffness. In particular, we investigated the change in elastic constants and their temperature dependence under ultra-high doping concentrations. The results show a monotonic decrease in c11 and a non-monotonic increase in c12 with both temperature and doping, while c44 remains relatively unaffected, consistent with experimental and theoretical studies. These changes are attributed to anisotropic carrier redistribution among conduction band valleys and strain-modulated interactions between valleys. The novelty of this work lies in the explicit, atomistically informed calculation of deformation potential constants using tight-binding parameters specific to phosphorus doping in silicon, enabling the accurate prediction of temperature-dependent elastic constants and anisotropic mechanical behaviour in emerging microsystem applications. Full article
(This article belongs to the Collection Women in Micromachines)
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19 pages, 4384 KiB  
Article
Porous Osteoplastic Composite Materials Based on Alginate–Pectin Complexes and Cation-Substituted Hydroxyapatites
by Galina A. Davydova, Inna V. Fadeeva, Elena S. Trofimchuk, Irina I. Selezneva, Muhriddin T. Mahamadiev, Lenar I. Akhmetov, Daniel S. Yakovsky, Vadim P. Proskurin, Marco Fosca, Viktoriya G. Yankova, Julietta V. Rau and Vicentiu Saceleanu
Polymers 2025, 17(13), 1744; https://doi.org/10.3390/polym17131744 - 23 Jun 2025
Viewed by 507
Abstract
Novel three-dimensional porous composites of alginate–pectin (A/P) with zinc- or manganese-substituted hydroxyapatites (A/P-ZnHA and A/P-MnHA) were synthesized via lyophilization and calcium cross-linking. Powder X-ray diffraction and infrared spectroscopy analyses confirmed single-phase apatite formation (crystallite sizes < 1 µm), with ZnHA exhibiting lattice contraction [...] Read more.
Novel three-dimensional porous composites of alginate–pectin (A/P) with zinc- or manganese-substituted hydroxyapatites (A/P-ZnHA and A/P-MnHA) were synthesized via lyophilization and calcium cross-linking. Powder X-ray diffraction and infrared spectroscopy analyses confirmed single-phase apatite formation (crystallite sizes < 1 µm), with ZnHA exhibiting lattice contraction (*c*-axis: 6.881 Å vs. 6.893 Å for HA). Mechanical testing revealed tunable properties: pristine A/P sponges exhibited an elastic modulus of 4.7 MPa and a tensile strength of 0.10 MPa, reduced by 30–70% by HA incorporation due to increased porosity (pore sizes: 112 ± 18 µm in the case of MnHA vs. 148 ± 23 µm-ZnHA). Swelling capacity increased 2.3–2.8-fold (125–155% vs. 55% for A/P), governed by polysaccharide interactions. Scanning electron microscopy investigation showed microstructural evolution from layered A/P (<100 µm) to tridimensional architectures with embedded mineral particles. The A/P-MnHA composites demonstrated minimal cytotoxicity for the NCTC cells and good viability of dental pulp stem cells, while A/P-ZnHA caused ≈20% metabolic suppression, attributed to hydrolysis-induced acidification. Antibacterial assays highlighted A/P-MnHA′s broad-spectrum efficacy against Gram-positive (Bacillus atrophaeus) and Gram-negative (Pseudomonas protegens) strains, whereas A/P-ZnHA targeted only the Gram-positive strain. The developed composite sponges combine cytocompatibility and antimicrobial activity, potentially advancing osteoplastic materials for bone regeneration and infection control in orthopedic/dental applications. Full article
(This article belongs to the Special Issue Functional Polymer Composites: Synthesis and Application)
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16 pages, 9595 KiB  
Article
Flexural Behavior of Concrete Slabs Reinforced with Embedded 3D Steel Trusses
by Javier Hernández-Pérez, Juan B. Pascual-Francisco, Alexander López-González, Adán Jiménez-Montoya and Orlando Susarrey-Huerta
Buildings 2025, 15(13), 2144; https://doi.org/10.3390/buildings15132144 - 20 Jun 2025
Viewed by 508
Abstract
This paper presents a proposal for slabs reinforced with 3D steel reinforcements. Two configurations of 3D steel reinforcement, manually fabricated using 4 mm diameter rods, were investigated: cubic and square pyramid truss lattices. Two control groups were produced: a non-reinforced slab and a [...] Read more.
This paper presents a proposal for slabs reinforced with 3D steel reinforcements. Two configurations of 3D steel reinforcement, manually fabricated using 4 mm diameter rods, were investigated: cubic and square pyramid truss lattices. Two control groups were produced: a non-reinforced slab and a linear steel rod-reinforced slab. Three-point bending tests were conducted to assess the flexural behavior of the slabs. The results were analyzed in terms of flexural strength, peak load, mid-span displacement, energy absorption, crack formation, and ductility. The digital image correlation (DIC) technique was employed to capture the full-field principal strain and determine the mid-span displacement at the point of crack initiation. Furthermore, the compression capacity of each slab was evaluated. The results were compared with those of the non-reinforced and linear reinforced slabs, revealing that the slab with the cubic truss lattice configuration exhibited the highest bending moment capacity. While the square pyramid truss slab demonstrated relatively low bending strength, it exhibited exceptional energy absorption characteristics. In terms of ductility, the cubic truss-reinforced slab showed superior performance. When compared to the slabs with linear rod reinforcement, the 3D-reinforced slabs with cubic and square pyramid configurations enhanced the bending strength by approximately 51.19% and 47.32%, respectively. Overall, this study shows that the oblique connectors in the pyramidal reinforcement, compared to the vertical connectors in the cubic reinforcement, provide greater ductility and promote a more uniform distribution of smaller cracks, thereby enhancing energy absorption. Full article
(This article belongs to the Special Issue Experimental and Theoretical Studies on Steel and Concrete Structures)
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14 pages, 4572 KiB  
Article
Synergistic Enhancement of Near-Infrared Electrochromic Performance in W18O49 Nanowire Thin Films via Copper Doping and Langmuir–Blodgett Assembly
by Yueyang Wu, Honglong Ning, Ruiqi Luo, Muyun Li, Zijian Zhang, Rouqian Huang, Junjie Wang, Mingyue Peng, Runjie Zhuo, Rihui Yao and Junbiao Peng
Inorganics 2025, 13(6), 200; https://doi.org/10.3390/inorganics13060200 - 14 Jun 2025
Viewed by 845
Abstract
The development of high-performance electrochromic materials demands innovative approaches to simultaneously control the nanoscale architecture and the electronic structure. We present a dual-modification strategy that synergistically combines copper doping with the Langmuir–Blodgett (LB) assembly to overcome the traditional performance trade-offs in tungsten oxide-based [...] Read more.
The development of high-performance electrochromic materials demands innovative approaches to simultaneously control the nanoscale architecture and the electronic structure. We present a dual-modification strategy that synergistically combines copper doping with the Langmuir–Blodgett (LB) assembly to overcome the traditional performance trade-offs in tungsten oxide-based electrochromic systems. Cu-doped W18O49 nanowires with varying Cu concentrations (0–12 mol%) were synthesized hydrothermally and assembled into thin films via the LB technique, with LB precursors characterized by contact angle, surface tension, viscosity, and thermogravimetric-differential scanning calorimetry (TG-DSC) analyses. The films were systematically evaluated using scanning electron microscopy, X-ray photoelectron spectroscopy, chronoamperometry, and transmittance spectroscopy. Experimental results reveal an optimal Cu-doping concentration of 8 mol%, achieving a near-infrared optical modulation amplitude of 76.24% at 1066 nm, rapid switching kinetics (coloring/bleaching: 5.0/3.0 s), and a coloration efficiency of 133.00 cm2/C. This performance is speculated to be a balance between Cu-induced improvements in ion intercalation kinetics and LB-ordering degradation caused by lattice strain and interfacial charge redistribution, while mitigating excessive doping effects such as structural deterioration and thermodynamic instability. The work establishes a dual-modification framework for designing high-performance electrochromic interfaces, emphasizing the critical role of surface chemistry and nanoscale assembly in advancing adaptive optoelectronic devices like smart windows. Full article
(This article belongs to the Special Issue Optical and Quantum Electronics: Physics and Materials)
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20 pages, 4520 KiB  
Article
Bandgap Tuning in Cobalt-Doped BiFeO3/Bi25FeO40 Heterostructured Nanopowders via Sol–Gel Phase Engineering
by Dhouha Baghdedi, Asma Dahri, Mohamed Tabellout, Najmeddine Abdelmoula and Zohra Benzarti
Nanomaterials 2025, 15(12), 918; https://doi.org/10.3390/nano15120918 - 12 Jun 2025
Viewed by 403
Abstract
Bismuth ferrite (BiFeO3, BFO) is a promising multiferroic material, but its optoelectronic potential is limited by a wide bandgap and charge recombination. Here, we report the sol–gel synthesis of Co-doped BiFeO3/Bi25FeO40 heterostructured nanopowders (x = 0.07, [...] Read more.
Bismuth ferrite (BiFeO3, BFO) is a promising multiferroic material, but its optoelectronic potential is limited by a wide bandgap and charge recombination. Here, we report the sol–gel synthesis of Co-doped BiFeO3/Bi25FeO40 heterostructured nanopowders (x = 0.07, 0.15) alongside pristine BFO to explore Co doping and phase engineering as strategies to enhance their functional properties. Using X-ray diffraction (XRD) with Rietveld refinement, Fourier-transform infrared spectroscopy (FTIR), field-emission scanning electron microscopy (FE-SEM), UV-Vis spectroscopy, and dielectric analysis, we reveal a biphasic structure (rhombohedral R3c and cubic I23 phases) with tuned phase ratios (~73:27 for x = 0.07; ~76:24 for x = 0.15). Co doping induces lattice strain and oxygen vacancies, reducing the bandgap from 1.78 eV in BFO to 1.31 eV in BFO0.15 and boosting visible light absorption. Dielectric measurements show reduced permittivity and altered conduction, driven by [Co2+-V0••] defect dipoles. These synergistic modifications, including phase segregation, defect chemistry, and nanoscale morphology, significantly enhance optoelectronic performance, making these heterostructures compelling for photocatalytic and photovoltaic applications. Full article
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10 pages, 6353 KiB  
Article
Electronic Structures of Molecular Beam Epitaxially Grown SnSe2 Thin Films on 3×3-Sn Reconstructed Si(111) Surface
by Zhujuan Li, Qichao Tian, Kaili Wang, Yuyang Mu, Zhenjie Fan, Xiaodong Qiu, Qinghao Meng, Can Wang and Yi Zhang
Appl. Sci. 2025, 15(11), 6150; https://doi.org/10.3390/app15116150 - 29 May 2025
Viewed by 425
Abstract
SnSe2, as a prominent member of the post-transition metal dichalcogenides, exhibits many intriguing physical phenomena and excellent thermoelectric properties, calling for both fundamental study and potential application in two-dimensional (2D) devices. In this article, we realized the molecular beam epitaxial growth [...] Read more.
SnSe2, as a prominent member of the post-transition metal dichalcogenides, exhibits many intriguing physical phenomena and excellent thermoelectric properties, calling for both fundamental study and potential application in two-dimensional (2D) devices. In this article, we realized the molecular beam epitaxial growth of SnSe2 films on a 3×3-Sn reconstructed Si(111) surface. The analysis of reflection high-energy electron diffraction reveals the in-plane lattice orientation as SnSe2[110]//3-Sn [112]//Si [110]. In addition, the flat morphology of SnSe2 film was identified by scanning tunneling microscopy (STM), implying the relatively strong adsorption effect of 3-Sn/Si(111) substrate to the SnSe2 adsorbates. Subsequently, the interfacial charge transfer was observed by X-ray photoemission spectroscopy. Afterwards, the direct characterization of electronic structures was obtained via angle-resolved photoemission spectroscopy. In addition to proving the presence of interfacial charge transfer again, a new relatively flat in-gap band was found in monolayer and few-layer SnSe2, which disappeared in multi-layer SnSe2. The interface strain-induced partial structural phase transition of thin SnSe2 films is presumed to be the reason. Our results provide important information on the characterization and effective modulation of electronic structures of SnSe2 grown on 3-Sn/Si(111), paving the way for the further study and application of SnSe2 in 2D electronic devices. Full article
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