Search Results (7,538)

This study investigates the kinetics of lipid oxidation and the antioxidant activity of lycopene in tomato pomace using a combined computational–experimental approach. A reaction mechanism describing initiation, propagation, hydroperoxide formation, and radical scavenging was implemented in ANSYS Chemkin 2025 R2 and simulated under controlled conditions at 50, 70, and 90 °C for up to 12 h. The model was validated using experimental measurements of linoleic acid, lycopene, and hexanal obtained from thermally treated tomato pomace. The results showed a strong temperature dependence of oxidation processes, with minimal changes at 50 °C and a transition to a propagation-dominated regime at 90 °C. Linoleic acid degradation reached 18.17% after 12 h at 90 °C, accompanied by a significant increase in hexanal formation, while lycopene loss remained below 5%. The model accurately reproduced experimental trends, with high correlation coefficients (R² = 0.9761 for linoleic acid, 0.9899 for lycopene, and 0.9982 for hexanal). Hydroperoxides were identified as key intermediates, accumulating prior to decomposition into volatile products. The results demonstrate that the proposed kinetic model provides a reliable tool for predicting lipid oxidation behavior in tomato by-products and highlights the critical influence of temperature on oxidative stability. Mean percentage errors ranged from 10.03% (hexanal) to 23.52% (linoleic acid), consistent with the complexity of the matrix. Full article

Rapid urbanization has intensified challenges regarding urban waterlogging and vehicle exhaust pollution. While permeable asphalt mixtures mitigate waterlogging and nano-TiO₂ offers photocatalytic exhaust degradation capabilities, the direct application of nano-TiO₂ is hindered by agglomeration and low photocatalytic efficiency. This study developed a composite modified nano-TiO₂ via metal ion doping and support treatment to enhance its performance in asphalt pavements. Specifically, nano-TiO₂ was doped with Fe³⁺, Ag⁺, and La³⁺ via the sol–gel method, and supported on activated carbon (AC) or Al₂O₃. The exhaust degradation performance was evaluated using a custom-built system, while dispersion properties were assessed via fluorescence microscopy and UV-Vis spectrophotometry. Furthermore, X-ray diffraction (XRD) and Fourier-transform infrared (FTIR) spectroscopy were conducted to investigate the microstructural mechanisms underlying the doping modification and support treatment. Photocatalytic permeable asphalt mixtures were prepared by partially replacing mineral powder with the composite modified nano-TiO₂ to validate exhaust degradation and pavement performance. The results indicated that metal doping substituted Ti⁴⁺ in the lattice, inducing defects and reducing crystallite size to boost photocatalytic activity. The optimal doping concentrations are determined to be 1.0% for Fe³⁺, 1.5% for Ag⁺, and 1.0% for La³⁺. Among these, Fe³⁺-doped nano-TiO₂ at 1.0% content exhibits superior exhaust degradation, achieving 46.7% efficiency for hydrocarbons (HC) and 33.5% for nitrogen oxides (NO). Regarding dispersion, while AC performs better at low support content, Al₂O₃ at 40% content provides superior dispersion properties by increasing active sites and surface hydroxyl groups. For photocatalytic permeable asphalt mixtures, replacing 40–50% of mineral filler with the composite modifier is recommended. The optimized mixture demonstrates superior exhaust degradation performance while maintaining the required high-temperature stability, low-temperature cracking resistance, water stability, and fatigue life. Specifically, compared to the control group, these indicators for the mixture with 50% of the mineral filler replaced by the composite modifier increases by 7.0%, 12.5%, 13.4%, and 22.9%, respectively. This study presents a viable technical solution for developing multifunctional asphalt mixtures with photocatalytic functionality as the core innovation and mechanical performance as the application baseline. Full article

Models are described for calculating the crack initiation times for Alloy 600 and Type 304 SS in PWR and BWR primary coolant circuits, respectively. In PWRs, initiation is defined in terms of the grain boundary oxidation concept of Scott and Le Calvar, whereas in BWRs, cracks are envisioned to nucleate from corrosion pits. In contrast, in BWRs, we envision cracks to nucleate from corrosion pits, with the difference in the two systems being primarily due to electrochemical factors. Thus, in BWR primary coolant and the absence of hydrogen water chemistry (HWC), the oxidizing conditions due to the radiolytic production of H₂O₂ cause the ECP to be significantly more positive than the critical pitting potential. Accordingly, the nucleation and growth of pits due to passivity breakdown and the establishment of differential aeration between the pit nucleus’s internal and external environments, which results in growth of pits to the critical size necessary to satisfy the Kondo criteria for transition of a pit into a crack, is judged to be a realistic scenario. Contrariwise, in PWR primary coolant, the ECP is so negative [≈−1.0 V_she] due to the large amount of pressurizing H₂ present in the circuit [20–60 cm³(STP)/kg H₂O] that the nucleation and growth of pits is not possible. However, Totsuka and Smialowska found that MA Alloy 600 suffers hydrogen-induced cracking (HIC) at an ECP < −0.85 V_she, demonstrating that, in service with a high hydrogen concentration, brittle fractures will occur. The initiation sites were not identified. The crack initiation models for Alloy 600 in PWRs and Type 304 SS in BWRs reproduce the effects of the following independent variables: applied stress, temperature, cold work, grain boundary segregations, water chemistry, pH, and electrochemical potential. The origins of the observed scatter in experimentally measured crack initiation times are discussed, and the challenges of developing a more general crack initiation model (GCIM) are identified. From a mathematical viewpoint, the most significant challenge arises from the nested distributions involving the many parameters and expressions within the GCIM that are either distributed because of an imprecise definition or because some experimentally determined input parameters are experimentally scattered. Additionally, the evolution of semi-elliptical surface cracks resulting from the electrochemical crack length (ECL) being shorter than the classical mechanical crack length (MCL) must be incorporated if the GCIM is to find utility in the water-cooled nuclear power industry where semi-elliptical surface cracks are normally observed. Full article

To overcome the inherent drawbacks of poly(propylene carbonate) (PPC), such as poor thermal stability, low mechanical strength, and high surface energy, this study introduced, for the first time, 1,1,1-trifluoro-2,3-epoxypropane (TF-PO) as a third monomer into the metal-free TEB/PPNCl catalytic system for the terpolymerization with carbon dioxide (CO₂) and propylene oxide (PO), successfully synthesizing a series of fluorinated PPC (PPCF). The optimal polymerization conditions ($60 °C$, 2.0 MPa, 12 h, n(PO):n(TF-PO) = 100:4) were determined through systematic optimization. Comprehensive structural characterization (FT-IR, NMR, XPS) confirmed the successful incorporation of TF-PO into the polymer backbone. Property evaluation revealed that the PPCF materials exhibited substantial improvements in thermal stability, mechanical strength, hydrophobicity, and dielectric properties compared to unmodified PPC. The optimal sample, PPCF4, achieved a $5\%$ weight-loss temperature ($T_{d,-5\%}$) of $242 °C$, a glass transition temperature ($T_{\mathrm{g}}$) of $42 °C$, a tensile strength of 21.5 MPa, and a Young modulus of 296 MPa. With a $5\%$ TF-PO feed ratio, the material’s water contact angle increased to 102°, and its dielectric constant reached 6.01 at ${10}^4$ Hz. Furthermore, density functional theory (DFT) calculations elucidated the Lewis acidity of the TEB catalyst and the reactive sites of the monomers, leading to a proposed mechanism for the ternary alternating copolymerization. This work provides an effective synthetic strategy and theoretical foundation for preparing high-performance and functionalized PPC materials through molecular structure design. Full article

Given the increasing demand for low-phosphorus molten iron in high-value-added steel production and the rising phosphorus content in raw materials caused by the use of high-phosphorus ores in blast furnaces, the traditional converter single-slag process faces challenges such as high dephosphorization pressure, high slag consumption, and unstable endpoint control. This study systematically investigates the process principles and key influencing factors of the converter double-slag method (MURC process) as an efficient pretreatment technology for molten iron. Through thermodynamic analysis combined with industrial tests, the core process parameters affecting dephosphorization efficiency were identified, including temperature, slag basicity (R), iron oxide (T.Fe) content, and bottom-blowing stirring intensity. The results show that the optimal temperature during the dephosphorization stage is 1350–1400 °C, with slag alkalinity controlled at 1.6–2.0 and T.Fe content maintained at 19–23%. During the decarburization stage, the optimal temperature is 1620–1640 °C, and the final slag alkalinity should be increased to above 3.5. After applying the optimized “low-high-low” oxygen supply pattern and enhanced bottom-blowing stirring (0.04–0.20 Nm³/(t·min)), significant improvements were achieved in industrial practice on 180-t and 60-t converters. Lime consumption was reduced by more than 30%, the average endpoint phosphorus content decreased by approximately 0.005%, the phosphorus removal rate remained stable at above 90%, and the oxygen content in molten steel at the endpoint decreased by 50–100 ppm. This study provides a systematic theoretical basis and practical guidance for efficient and stable dephosphorization using the converter double-slag process. Full article

Tea (Camellia sinensis L.) flowers have recently gained attention due to their bioactive composition, similar to that of tea leaves. They are used in food and cosmetic applications and show potential for medicinal use. However, catechins in tea flowers are highly susceptible to oxidation by polyphenol oxidase (PPO), leading to enzymatic browning. This process alters the phenolic profile and results in losses in appearance, nutritional value, and overall product quality. In this study, PPO from tea flowers was purified using affinity chromatography with a yield of 11.31% and a 91.90-fold purification. The molecular weight was determined to be approximately 42.67 kDa by SDS–PAGE. Substrate specificity studies revealed the highest activity toward catechin. Optimum pH and temperature were determined to be 5.0 and 40 °C, respectively. K_m and V_max values for catechin were 0.42 mM and 8333.3 EU·mL⁻¹·min⁻¹, respectively. The enzyme showed high stability at pH 5.0–7.0 and remained active for 60 min at 30 °C and 40 °C. L-cysteine was found to be the most effective of the inhibitors studied. These findings contribute to the understanding of the enzymatic browning mechanism of tea flower PPO and provide important data for enzyme control in food, cosmetic, and medical applications. Full article

The corrosion behavior of high-entropy alloys under cyclic wet–dry conditions simulating the salt-lake atmosphere was investigated. The composition, morphology, and electrochemical properties of the corrosion products formed on the alloy surface after corrosion were systematically analyzed. The results show that in a chloride-containing environment with alternating temperature and humidity, the Cr-containing oxide passive film formed on the alloy surface effectively inhibits the corrosion process in the early stages. In addition, electrochemical results show that the charge transfer resistance in the MgCl₂ system reaches 4.96 × 10⁵ Ω·cm² at prolonged exposure, which is significantly higher than that in the NaCl system, indicating a lower corrosion rate. However, over time, the passive film undergoes localized rupture due to chloride ion attack and stress, leading to pitting corrosion and expansion toward the substrate. This study reveals the corrosion mechanism of high-entropy alloys in high-altitude salt-lake atmospheric environments and provides crucial insights for material design and performance optimization for their engineering applications in salt-lake scenarios. Full article

Carbon monoxide (CO) is a highly toxic, colorless, and odorless gas posing significant risks to human health and the environment. Catalytic oxidation offers a promising, economically viable solution by converting CO into nontoxic CO₂ under mild conditions without energy-intensive regeneration. However, existing MnO₂-based catalysts often exhibit poor activity and stability in harsh environments, particularly at low temperatures and high humidity. In this study, we propose a Cu²⁺ ion-exchange modification strategy to activate lattice oxygen species in δ-MnO₂, thereby significantly enhancing its low-temperature CO oxidation performance. Structural characterization by XRD and SEM confirms that Cu-doped δ-MnO₂ retains its original birnessite-type structure and porous morphology. ICP-OES and XPS analyses verify that Cu²⁺ ions effectively replace interlayer K⁺ ions. The resulting MnO₂-150Cu catalyst demonstrates exceptional activity, achieving 100% CO conversion at 40 °C in dry air and maintaining full conversion at 80 °C in the presence of 1.3 vol.% H₂O at a weight hourly space velocity of 150 L/g·h. H₂-TPR and O₂-TPD results confirm that Cu doping enhances the reducibility and mobility of lattice oxygen. Furthermore, in situ DRIFTS analysis reveals that the migration of active oxygen species is the rate-limiting step at low temperatures. This work provides a novel and effective strategy for activating lattice oxygen in MnO₂-based catalysts, offering a promising pathway for developing high-performance materials for low-temperature CO oxidation under practical environmental conditions. Full article

Background:Pinellia ternata is a major medicinal herb widely utilized in traditional medicine, but is sensitive to high temperature, which often triggers a severe “sprout tumble” phenomenon. Methods: To elucidate the molecular mechanisms of heat tolerance in P. ternata, we screened two contrasting germplasms: the heat-tolerant JBX1 and the heat-sensitive XBX4. In the present study, a combined analysis of physiology, transcriptome, and metabolome was performed on JBX1 and XBX4 under heat stress at 40 °C. Results: JBX1 exhibited significantly greater leaf thickness, higher basal chlorophyll content, more stable antioxidant enzyme activities, and lower oxidative damage than XBX4 under heat stress. Transcriptomically, JBX1 maintained elevated basal expression of genes encoding key enzymes in carbon fixation, amino acid metabolism, and phenylpropanoid biosynthesis, as well as those encoding heat shock transcription factors (HSFs), heat shock proteins (HSPs), and the thermosensor Thermo-With ABA-Response 1 (TWA1). Metabolomically, JBX1 accumulated higher levels of key primary metabolites, antioxidants, and protective phenylpropanoids under both control and heat conditions. Notably, a “polarity reversal” emerged in nitrogen metabolism, where core amino acids accumulated in JBX1 but were depleted in XBX4. Integrated analysis revealed a more coordinated gene–metabolite network in JBX1 involving the phenylpropanoid, ATP-binding cassette (ABC) transporter, and glutathione pathways. Conclusions: Our findings demonstrate that JBX1 possessed stronger basal thermotolerance, which is derived from coordinated establishment of higher constitutive metabolic reserves and efficient dynamic metabolic reprogramming. This study provides insights into the molecular mechanisms of heat stress in P. ternata. Full article

This study describes the development of an electrochemical sensor for quantitatively measuring acetaminophen (ACOP) in drug tablets. The sensor design is based on the modification of glassy carbon electrode (GCE) using zinc oxide nanoparticles (ZnONPs) embedded in a naturally occurring clay matrix (Sa) functionalized with phenylalanine (Phe). To ensure that the ZnONPs are homogeneously dispersed on the clay surface, the nanocomposite was synthesized using an impregnation approach and low-temperature heat treatment. The amino acid promotes specific interactions with ACOP through hydrogen bonding and π-π stacking, acting as both a stabilizing agent and a molecular recognition moiety. FTIR, UV-Vis, XRD, and FESEM/EDX mapping were employed to fully characterize the developed material (ZnONPs-Sa/Phe). Cyclic voltammetry (CV) and differential pulse voltammetry (DPV) were used for the electrochemical determination of ACOP using the modified electrode GCE/ZnONPs-Sa/Phe. Parameters susceptible to affecting the sensitivity of the developed sensor were optimized, revealing that 5 µL of the suspension ZnONPs-Sa/Phe immobilized on GCE was ideal for the sensing of ACOP in a phosphate buffer solution at pH 2.0. The calibration curve obtained by plotting peak current intensity against ACOP concentration exhibited linear behavior within the concentration range between 0.02 µM and 0.28 µM, enabling determination of the limits of detection (LOD) and quantitation (LOQ) at 8.54 × 10⁻⁹ M and 2.84 × 10⁻⁸ M, respectively. The reproducibility, stability, and selectivity of the sensor were evaluated, followed by its application to the nano-sensing of ACOP in Africure and Doliprane tablets, yielding satisfactory results. The simplicity, affordability, and high analytical sensitivity of the developed sensor make this sensing platform a promising tool for pharmaceutical quality control applications. Full article

Molten salt chlorination is a key industrial route for producing titanium tetrachloride (TiCl₄), yet the atomistic catalytic role of iron (Fe) in the carbothermic chlorination of titanium oxides remains unclear. Here, the chlorination behavior of the NaCl–C–Cl₂–FeTiO₃ system was investigated by combining thermodynamic calculations with Ab Initio Molecular Dynamics (AIMD) and Deep Potential Molecular Dynamics (DPMD) simulations. AIMD results show that carbon adjacent to Fe exhibits enhanced reactivity, and that Fe-C synergistic electron transfer promotes both titanium oxide reduction and subsequent titanium chlorination. DPMD results further reveal that Fe not only accelerates these transformations, but also improves interfacial contact among carbon, titanium oxides, and molten salt, thereby enhancing mass transfer and shortening the formation time of TiCl₄. Temperature-dependent analysis indicates that Fe-C and C-O coordination numbers remain high near 1073 K, where TiCl₄ formation is efficient and relatively stable. Although increasing temperature can further enhance diffusion, its effect on reaction acceleration is limited, while excessively high temperatures weaken Fe-C interactions and reduce catalytic efficiency. These findings clarify the catalytic mechanism of Fe in molten salt chlorination at the atomic scale and provide theoretical support for process optimization. Full article

Ventilation air methane (VAM) has an extremely low concentration, making its abatement exceptionally challenging. Catalytic oxidation offers a promising route for VAM treatment, but industrial application requires integrated catalysts with high activity and efficient mass transfer. In this study, a novel straight-channel NiO/CeO₂ ceramic reactor was fabricated via mesh-assisted phase inversion, with NiO content systematically optimized to screen the optimal ratio. The 60 wt% NiO was the optimal composition, exhibiting excellent VAM oxidation performance. Brunauer–Emmett–Teller (BET) analysis confirmed that this optimal ratio yielded the largest specific surface area. Furthermore, H₂-temperature-programmed reduction (H₂-TPR) and X-ray photoelectron spectroscopy (XPS) confirmed that this optimal ratio facilitated the formation of abundant NiO–CeO₂ active interfaces, effectively inducing surface Ce³⁺ species and oxygen vacancies. These merits significantly enhanced the reactor’s oxygen adsorption capacity and redox properties, thus realizing efficient methane activation in catalytic oxidation. Moreover, the optimal reactor successfully passed 10 thermal cycle tests, further verifying the thermal stability of the catalytic structure. In addition, it exhibited outstanding long-term stability during a 100 h test, with no carbon deposition or active phase sintering observed. This work develops an optimized straight-channel NiO/CeO₂ ceramic reactor and offers a practical and scalable design strategy for VAM oxidation. Full article

To address the increasing demands for lightweight, high-temperature resistant braking materials under extreme service conditions, a novel C_f/SiC-B₁₂(C,Si,B)₃ composite was developed in this work. The composite was fabricated via a hybrid slurry infiltration-reactive melt infiltration (SI-RMI) process. The tribological performance under coupled temperature–velocity conditions was systematically evaluated using a ball-on-disk tester over temperatures from 25 to 600 °C (at 900 r/min) and sliding speeds from 300 to 900 r/min (at 600 °C). The results indicate that temperature dominates the friction and wear behavior. At room temperature, the composite exhibits a friction coefficient of 0.52 and a wear rate of 4.019 × 10⁻⁴ mm³/(N·m). With increasing temperature, friction coefficients decreased to 0.43 at 400 °C and 0.41 at 600 °C, while wear rates increased sharply to 12.025 × 10⁻⁴ mm³/(N·m) at 400 °C before declining to 5.228 × 10⁻⁴ mm³/(N·m) at 600 °C. Under the fixed temperature of 600 °C, raising rotational speed from 300 to 900 r/min increased the wear rate only marginally (4.953 to 5.228 × 10⁻⁴ mm³/(N·m)). Surface analysis indicates that a continuous Si-B-O oxide layer (mainly SiO₂ and B₂O₃) forms at 600 °C, which may provide solid lubrication and oxidation resistance. The present work offers a preliminary exploration of the tribological evolution and self-lubrication mechanisms of C_f/SiC-B₁₂(C,Si,B)₃ composites, providing potential insights for the design of advanced ceramic-matrix braking materials. Full article

This study evaluated the effects of heat stress on productive performance, physiology, reproduction, and oxidative status in pregnant New Zealand White (NZW) rabbit does, as well as the potential synergistic effects of curcumin and vitamin D3 (Cur + VD₃) supplementation in alleviating these stress-induced impairments. Eighty multiparous does (12–18 months old) were assigned to a 2 × 2 factorial design involving two ambient temperatures (indoor vs. outdoor) and two supplementation levels (with or without Cur + VD₃). Outdoor does experienced severe heat stress (THI = 33.22) compared to indoor thermal comfort conditions (THI = 25.13). The supplement (Cur + VD₃) was administered orally at 1 mL/kg body weight. Heat stress significantly decreased body weight, milk yield, litter size, weight at weaning, and behavioral activity. Conversely, rectal temperature, respiration rate, and mortality increased. Supplementation with Cur + VD₃ showed improved body weight, reproductive parameters, milk yield, and behavior, while reducing mortality (0% vs. 5%) compared to treatment without these additives. Physiologically, Cur + VD₃ lowered rectal temperature and respiration rate. In conclusion, combined curcumin and vitamin D₃ supplementation is an effective nutritional strategy to improve heat stress tolerance and maintain productivity in pregnant rabbits exposed to high ambient temperatures. Full article

Low-temperature Cu sintering is used as a die-bonding strategy for the third-generation power device, and the Cu-sintered joints require long-term stability at elevated temperature. In this work, we investigate the thermal stability and microstructural evolution of the Cu interconnect joints with an ultra-thin sintered layer at the temperature of 250 °C in air. The as-prepared joint shows a dense well-bonded interface with low porosity before the thermal aging test. The average shear strength of the joints increases from 85.5 MPa to 91.3 MPa after aging up to 300 h. With further increase in aging time, the shear strength begins to decrease. However, the strength remains at a high level of 69.8 MPa even after 500 h of aging, satisfying the requirements for high-temperature stability. At short aging times, the porosity within the interface reduces slightly, and the fracture exhibits distinct ductile characteristics. When the aging time exceeds 300 h, the oxide content at the interface increases from the outer region toward the inner part, and aging cracks eventually appear at the edge of the sintered layer. Therefore, it is demonstrated that the dense and thin sintered layer limits oxygen diffusion, guaranteeing the high-temperature stability of the sintered joint. Full article