Search Results (3,357)

Organic phase change materials (OPCMs) offer high energy density for thermal storage but suffer from crystallization kinetics dependent on ambient temperature, leading to uncontrolled heat release and limited storage lifetime. Although doping OPCMs with azobenzene (Azo) derivatives enables optically controlled energy storage and release, existing systems require UV irradiation for E-to-Z isomerization. This UV dependency seriously hinders their development in practical solar applications. Herein, we develop a visible-light-responsive Azo@OPCM composite by doping tetra-ortho-fluorinated azobenzene into eicosane. Systematic characterization of composites with different dopant ratios via UV–visible spectroscopy and differential scanning calorimetry reveals that green-light irradiation drives E-to-Z isomerization, achieving 97–99% Z-isomer conversion. This photoisomerization could introduce supercooling through photo-responsive energy barriers generated by Z-isomer, allowing thermal energy storage at lower temperatures. Subsequent blue-light irradiation triggers Z-to-E reversion to eliminate supercooling and enable optically controlled heat release. Additionally, by regulating the molar ratios of dopant, the optimized composites achieved 280.76 J/g energy density at 20% molar doping ratio, which surpassed that of pure eicosane and the reported Azo-based photothermal energy storage system. This work establishes a complete visible-light-controlled energy harvesting–storage–release cycle with significant potential for near-room-temperature solar thermal storage applications. Full article

This study investigates the structural transformation from the γ-phase into the α-phase in bio-based nylon 5,6 fibers during in situ uniaxial stretching, using X-ray diffraction (XRD) and density functional theory (DFT) calculations. Initially, nylon 5,6 films exhibited a well-defined γ-phase crystalline structure, and the as-spun fibers also retained a γ-phase-dominant structure with partial coexistence of α-phase components. Due to the lattice similarity between the γ- and α-phases, phase separation was challenging in the direction perpendicular to the fiber axis (ab-plane). However, the analysis of the (004) diffraction peaks along the fiber axis (c-axis) enabled the quantitative evaluation of each crystalline component. As the stretching progressed, the α(004) peak intensity gradually increased, indicating a continuous γ-to-α structural transition. Furthermore, DFT calculations revealed that the α-phase has lower energy than the γ-phase, supporting the thermodynamic favorability of the phase transition during elongation. These results provide a comprehensive understanding of the crystalline structure and transformation mechanism in environmentally friendly nylon fibers from both experimental and theoretical perspectives, and offer foundational insights for developing nylon materials with desirable properties through the precise control of crystal phase structures. Full article

This study aims to further analyze the chemical characteristics of mountainous forest cultivated ginseng (MFCG) and garden ginseng (GG), concerning their calcium oxalate crystals, organic acids, and ginsenosides. The results demonstrate that MFCG had higher levels of non-free oxalate, calcium oxalate crystals, and most ginsenosides, while GG had higher fumaric acid/total organic acids. The content of non-free oxalate and calcium oxalate crystals in rhizome was the highest, showing a positive correlation with the growth years (5–20 years). In most cases, in MFCG, non-free oxalic acid ≥ 0.8%, calcium oxalate ≥ 160/mg, fumaric acid/total organic acids < 9%, Rb1 ≥ 6 mg/g, PPD/PPT was close to 2, and Rb1/Ro ≥ 2.5, while in GG, non-free oxalic acid < 0.8%, calcium oxalate ≤ 60/mg, fumaric acid/total organic acids ≥ 9%, Rb1 < 6 mg/g, PPD/PPT was close to 1, and Rb1/Ro < 2.5. These results can be used as the basis for distinguishing between GG and MFCG. Chemometric analysis of non-free oxalate, calcium oxalate crystals, and ginsenosides could distinguish MFCG from GG. Chemometric analysis of succinate, citrate, and malonic acids could mostly differentiate MFCG of over 15 years from that of less than 12 years. As far as we know, the present study is the first to determine the difference in the ratio of ginsenosides (Rb1/Ro, PPD/PPT) and the ratio of organic acids, which provides an innovative method for the distinction between the two and a scientific basis for effective quality control of MFCG. Full article

Foodborne pathogenic biofilms pose significant challenges to food safety due to their enhanced resistance to conventional antimicrobial agents. In this study, we evaluated the synergistic antibiofilm activity of oregano essential oil (OEO) from Lippia graveolens and the lytic bacteriophage phiLLS against six foodborne bacteria. GC–MS analysis achieved a 100% identification ratio, revealing that OEO was mainly composed of carvacrol (58.9%), p-cymene (28.6%), γ-terpinene (2.9%), and caryophyllene (2.6%). The MIC and MBC of OEO were 1 and 2 mg/mL, respectively, for all strains except E. coli BALL1119 (MIC = 2 mg/mL). We assessed biofilm biomass by crystal violet (CV) staining and metabolic activity using the TTC assay under both individual and combined treatments, monitored 9-hour planktonic growth kinetics to calculate Bliss and HSA synergy indexes, and employed atomic force microscopy (AFM) to visualize nanoscale alterations in Staphylococcus aureus and Escherichia coli BALL1119 biofilms. Combined OEO (2 mg/mL) and phiLLS (MOI 1) treatments achieved significantly greater biofilm biomass reduction than single agents, notably yielding >70% inhibition of S. aureus biofilms (p < 0.05) and a Bliss synergy index of 10.8% in E. coli BALL1119 growth kinetics, whereas other strains were additive. In biofilm assays, S. aureus and Salmonella spp. showed the highest reductions in biomass (CV) (71.0% and 67.8%, ΔHSA = 27.0% and 17.4%; ΔBliss = 21.1% and 13.8%) and metabolic activity (TTC) (68.6% and 48.5%). AFM revealed that OEO alone smoothed the extracellular matrix (averaging a 35% reduction in roughness), whereas the combined treatment caused fracturing (≈68 nm roughness) and prominent lytic pits. Although variability in S. aureus biofilm architecture precluded statistically significant pairwise comparisons, AFM topography and consistent trends in Ra/Rz parameters provided clear visual corroboration of the significant reductions detected by CV and TTC assays. These complementary data indicate that OEO primes the biofilm matrix for enhanced phage-mediated collapse, offering a green, two-step strategy for controlling resilient foodborne biofilms. Full article

The monitoring of gases and vapors using portable instruments is critical in a variety of fields, such as industrial and household safety, environmental monitoring, process control, and national security, owing to gas pollution. In this study, we design a portable and simple two-dimensional photonic crystal microcavity sensor for detecting gases such as ammonia, methane, carbon monoxide, acetylene, ethylene, and ethane. The basic structure of the sensor consists of silicon rods arranged in a square lattice pattern in air. Waveguide input and output channels are realized by engineering line defects within the lattice structure. Moreover, the sensor’s performance is continuously optimized by adding point defects, introducing a ring cavity, and varying the radius of the dielectric rods in the microcavity. Using the transmission spectrum obtained from the output waveguide, the performance parameters of the gas sensor are calculated. Based on the simulation analysis, the optimized gas sensor exhibits excellent performance, achieving a sensitivity S of 932.43 nm/RIU and a quality factor Q of 2421.719. Full article

A para-substituted 1,10-phenanthroline ligand, 2-(4-methylphenoxy)-1,10-phenanthroline (L24), was synthesized and structurally characterized. Complexes with Eu³⁺, Tb³⁺, Sm³⁺, and Dy³⁺ were obtained in a 2:1 ligand-to-metal ratio and analyzed using single-crystal x-ray diffraction, photoluminescence spectroscopy, and TD-DFT calculations. Coordination via the phenanthroline nitrogen atoms, combined with steric asymmetry from the para-methylphenoxy group, induces low-symmetry environments favorable for electric-dipole transitions. Excited-state lifetimes reached 2.12 ms (Eu³⁺) and 1.12 ms (Tb³⁺), with quantum yields of 42% and 68%, respectively. The triplet-state energy of L24 (22 741 cm⁻¹) aligns well with emissive levels of Eu³⁺ and Tb³⁺, consistent with Latva’s criterion. Fluorescence titrations indicated positively cooperative complexation, with association constants ranging from 0.60 to 1.67. Stark splitting and high ⁵D₀→⁷F₂/⁷F₁ intensity ratios (R₂ = 6.25) confirm the asymmetric coordination field. The para-methylphenoxy substituent appears sufficient to lower coordination symmetry and strengthen electric-dipole transitions, offering a controlled route to enhance photoluminescence in Eu³⁺ and Tb³⁺ complexes. Full article

To unravel the link between agate geochemistry, host volcanic rocks, and ore-forming processes, this study integrated elemental correlation analysis, interaction interpretation, and interpretable machine learning (LightGBM-SHAP framework with SMOTE and 5-fold cross-validation) using 203 in-situ element datasets from 16 global deposits. The framework achieved 99.01% test accuracy and 97.4% independent prediction accuracy in discriminating host volcanic rock types. Key findings reveal divergence between statistical elemental correlations and geological interactions. Synergies reflect co-migration/co-precipitation, while antagonisms stem from source competition or precipitation inhibition, unraveling processes like stepwise crystallization. Rhyolite-hosted agates form via a “crust-derived magmatic hydrothermal fluid—medium-low salinity complexation—multi-stage precipitation” model, driven by high-silica fluids enriching Sb/Zn. Andesite-hosted agates follow a “contaminated fluid—hydrothermal alteration—precipitation window differentiation” model, controlled by crustal contamination. Basalt-hosted agates form through a “low-temperature hydrothermal fluid—basic alteration—progressive mineral decomposition” model, with meteoric water regulating Na-Zn relationships. Zn acts as a cross-lithology indicator, tracing crust-derived fluid processes in rhyolites, feldspar alteration intensity in andesites, and alteration timing in basalts. This work advances volcanic-agate genetic studies via “correlation—interaction—mineralization model” coupling, with future directions focusing on large-scale micro-area elemental analysis. Full article

The aim of this study is an interdisciplinary assessment of the potential of cement pastes to permanently bind carbon dioxide (CO₂) under anaerobic digestion conditions, considering technological, microstructural, environmental, and economic aspects. The research focused on three types of Portland cement: CEM I 52.5N, CEM I 42.5R-1, and CEM I 42.5R-2, differing in phase composition and reactivity, which were evaluated in terms of their carbonation potential and resistance to chemically aggressive environments. The cement pastes were prepared with a water-to-cement ratio of 0.5 and subjected to 90-day exposure in two environments: a reference environment (tap water) and a fermentation environment (aqueous suspension of poultry manure simulating biogas reactor conditions). XRD, TG/DTA, SEM/EDS, and mercury intrusion porosimetry were applied to analyze CO₂ mineralization, phase changes, and microstructural evolution. XRD results revealed a significant increase in calcite content (e.g., for CEM I 52.5N from 5.9% to 41.1%) and the presence of vaterite (19.3%), indicating intense carbonation under organic conditions. TG/DTA analysis confirmed a reduction in portlandite and C-S-H phases, suggesting their transformation into stable carbonate forms. SEM observations and EDS analysis revealed well-developed calcite crystals and the dominance of Ca, C, and O, confirming effective CO₂ binding. In control samples, hydration products predominated without signs of mineralization. The highest sequestration potential was observed for CEM I 52.5N, while cements with higher C₃A content (e.g., CEM I 42.5R-2) exhibited lower chemical resistance. The results confirm that carbonation under fermentation conditions may serve as an effective tool for CO₂ emission management, contributing to improved durability of construction materials and generating measurable economic benefits in the context of climate policy and the EU ETS. The article highlights the need to integrate CO₂ sequestration technologies with emission management systems and life cycle assessment (LCA) of biogas infrastructure, supporting the transition toward a low-carbon economy. Full article

In this study, canola oil was used as a natural enriched source of C18 fatty acids and coconut oil as a natural enriched source of C12 fatty acids. The study synthesized five potassium carboxylate (RCOO⁻K⁺) liquid soaps via saponification of coconut–canola oil blends (100:0, 75:25, 50:50, 25:75, 0:100) using a novel in situ dissolution method with controlled KOH addition to prevent solid paste formation. The water demand required to dissolve RCOO⁻K⁺ and mitigate soap crystallization was determined, increasing from 1.76 to 5.18 g H₂O/g oil as canola oil content rose, with soap concentration decreasing from 55.1% (100:0) to 18.5% (0:100). Reaction kinetics revealed faster KOH depletion in coconut oil-rich blends (100:0, 75:25, 50:50; 2 h) compared to canola oil-rich blends (25:75, 0:100; 8 h). Key soap properties, including foam stability, detergency, wettability, viscosity, and thermal behavior, were assessed. The 50:50 blend exhibited the highest foam stability due to the synergistic effects of medium-chain saturated (e.g., laurates) and long-chain unsaturated (e.g., oleates) RCOO⁻K⁺. The short, saturated chains promoted rapid foam formation, while the longer, unsaturated chains enhanced foam film stability. RCOO⁻K⁺ detergency on hair tresses with artificial sebum ranged from 16.9% to 29.7% and was relatively higher compared to sodium lauryl sulfate, sodium laureth sulfate, cocamidopropyl betaine, and sodium cocoyl glutamate (6.1–13.2%) but lower compared to sodium isethionates (34.2%). RCOO⁻K⁺ wettability on cotton textiles improved with higher coconut oil content. RCOO⁻K⁺ contact angles on artificial sebum surface (6.1–13.7°) demonstrated excellent wettability, effectively penetrating and emulsifying hydrophobic residues. Viscosity ranged from 13–45 mPa·s with Newtonian Flow-type behavior. No crystals were observed in the soaps when cooled in the range of 60 to −30 °C. These results demonstrate RCOO⁻K⁺ soaps as tunable, sustainable liquid soaps with performance optimized by adjusting the oil blend ratios. Full article

Tunability of the localized surface plasmon resonance (LSPR) peak position of gold and silver nanoparticle arrays embedded in a liquid crystal cell is investigated in this paper. The extinction spectra are computed using the Finite-Difference Time Domain (FDTD) simulation algorithms. Results show that the LSPR properties exhibit significant dependence on nanoparticle size and shape, array periodicity, and liquid crystal layer thickness. Notably, the LSPR wavelength saturates when the liquid crystal thickness exceeds a critical value. Furthermore, controlled rotation of the liquid crystal optical axis within distinct planes (xoy and xoz) reveals systematic variations in LSPR characteristics. Finally, we identify the key factors governing the LSPR spectral sensitivity of these noble metal nano-arrays. Full article

The Dulong Sn-polymetallic deposit in Yunnan Province of southwestern China serves as a unique case study for unraveling the evolution of skarn systems and tin mineralization. Four distinct garnet types (Grt I to Grt IV) were classified based on petrographic observations. Compositional analysis reveals a progression from Grt I to Grt III, marked by increasing andradite components, and elevated tin concentrations, peaking at 5039 ppm. These trends suggest crystallization from Sn-enriched magmatic-hydrothermal fluids. In contrast, Grt IV garnet exhibits dominant almandine components and minimal tin content (<2 ppm). Its association with surrounding rocks (schist) further implies its metamorphic origin, distinct from the magmatic origin of the other garnet types. Combined with previously published sulfur and lead isotopic data, as well as trace element compositions of garnet, our study suggests that Laojunshan granites supply substantial ore-forming elements such as S, Pb, W, Sn, In, and Ga. In contrast, elements such as Sc, Y, and Ge are inferred to be predominantly derived from, or buffered by, the surrounding rocks. The geochemical evolution of the garnets highlights the critical role of redox fluctuations and fluid chemistry in controlling tin mineralization. Under neutral-pH fluid conditions, early-stage garnets incorporated significant tin. As the oxygen fugacity of the ore-forming fluid declined, cassiterite precipitation was triggered, leading to tin mineralization. This study reveals the interplay between fluid redox dynamics, garnet compositional changes, and mineral paragenesis in skarn-type tin deposits. Full article

Thickness-controlled, easily patterned upconversion (UC) nanofilms are essential for high-precision optoelectronic devices, but challenges such as imprecise thickness control and low fluorescence intensity hinder their application. High-performance lanthanide-doped sodium yttrium fluoride UC materials are typically available in powder form, making direct integration into advanced devices difficult. Although physical vapor deposition (PVD) enables precise film formation, it often produces poor crystalline structures and weak fluorescence. To overcome these limitations, integrating non-noble plasmonic Ni with surface plasmon resonance to enhance fluorescence intensity is a promising yet understudied strategy, likely due to Ni’s ultraviolet resonant wavelength and oxidation susceptibility. This study introduces an integrated Ni-UC nanofilm design, combining an ultrathin Ni layer with a NaYF₄:Tm, Yb UC layer via PVD, followed by post-annealing. Annealing at 500 °C transforms the UC layer into a hexagonal-phase crystal structure while protecting the Ni layer from oxidation. The unannealed UC nanofilm showed no fluorescence, whereas the annealed UC nanofilm displayed clear peaks at 476, 648, and 699 nm. Notably, the integrated Ni-UC nanofilm exhibited fluorescence intensities 5.29, 4.43, and 4.29 times higher at these wavelengths, respectively. Additionally, the integrated design exhibited high transparency and stability, highlighting its protective benefits. These results underscore the potential of the integrated Ni-UC nanofilm for advanced optoelectronics and sensing technologies, offering enhanced fluorescence, micro-processing compatibility, and robust performance in a cost-effective, non-noble plasmonic system. Full article

The absence of parental presence has a direct impact on the emotional stability and social routines of children, especially during extended periods of separation from their family environment, as in the case of daycare centers, hospitals, or when they remain alone at home. At the same time, the technology currently available to provide emotional support in these contexts remains limited. In response to the growing need for emotional support and companionship in child care, this project proposes the development of a multi-platform software architecture based on artificial intelligence (AI), designed to be integrated into humanoid robots that assist children between the ages of 6 and 14. The system enables daily verbal and non-verbal interactions intended to foster a sense of presence and personalized connection through conversations, games, and empathetic gestures. Built on the Robot Operating System (ROS), the software incorporates modular components for voice command processing, real-time facial expression generation, and joint movement control. These modules allow the robot to hold natural conversations, display dynamic facial expressions on its LCD (Liquid Crystal Display) screen, and synchronize gestures with spoken responses. Additionally, a graphical interface enhances the coherence between dialogue and movement, thereby improving the quality of human–robot interaction. Initial evaluations conducted in controlled environments assessed the system’s fluency, responsiveness, and expressive behavior. Subsequently, it was implemented in a pediatric hospital in Guayaquil, Ecuador, where it accompanied children during their recovery. It was observed that this type of artificial intelligence-based software, can significantly enhance the experience of children, opening promising opportunities for its application in clinical, educational, recreational, and other child-centered settings. Full article

Lead-free A₂ZrX₆ “defect” perovskites hold significant potential for many optoelectronic applications due to their stability and tunable properties. Extending a previous work, we present a first-principles density functional theory (DFT) study, utilizing PBE and HSE06 functionals, to systematically investigate the impact of A-site cation and X-site halogen substitutions on the structural and electronic properties of these materials. We varied the A-site cation, considering ammonium, methylammonium, dimethylammonium, trimethylammonium, and phosphonium, and the X-site halogen, trying Cl, Br, and I. Our calculations reveal that both these substitutions significantly affect the band gap and the lattice parameters. Increasing A-site cation size generally enlarges the unit cell, while halogen electronegativity directly correlates with the band gap, yielding the lowest values for iodine-containing systems. We predict a broad range of band gaps (from ~4.79 eV for (PH₄)₂ZrCl₆ down to ~2.11 eV for MA₂ZrI₆ using HSE06). The (PH₄)₂ZrX₆ compounds maintain cubic crystal symmetry, unlike the triclinic of the ammonium-derived systems. Finally, our calculations show that the MA cation yields the smallest band gap among the ones studied, a result that is attributed to its size and the charges of the hydrogen atoms attached to nitrogen. Thus, our findings offer crucial theoretical insights into A₂ZrX₆ structure–property relationships, demonstrating how A-site cation and halogen tuning enables control over electronic and structural characteristics, thus guiding future experimental efforts for tailored lead-free perovskite design. Full article

Background/Objectives: Yersinia enterocolitica is a pathogenic bacterium that forms biofilms, enhancing its persistence and resistance to antimicrobial agents. Biofilm formation in Y. enterocolitica is influenced by environmental factors such as temperature, calcium, and the presence of the virulence plasmid pYV. This study aims to explore how temperature, calcium, and pYV modulate biofilm formation in Y. enterocolitica, with a focus on motility and extracellular polymeric substance (EPS) production as key factors. Methods: Y. enterocolitica strains with and without the pYV plasmid were cultured at two different temperatures (26 °C and 37 °C). The effect of calcium (5 mM) on biofilm formation was tested at both temperatures. Biofilm formation was measured using crystal violet staining, motility was assessed using soft agar plates, and EPS production was quantified to determine its role in biofilm stabilization. Results: At 26 °C, biofilm formation increased in pYV-negative strains, driven primarily by motility and flagellar expression. In contrast, at 37 °C, pYV-positive strains showed strong biofilm formation despite reduced growth, with EPS production as the key stabilizing factor. Calcium modulated biofilm formation in a temperature-dependent manner: at 26 °C, 5 mM calcium modestly reduced biofilm formation in pYV-negative strains, while at 37 °C, it significantly suppressed both EPS production and biofilm formation by approximately 50% in pYV-positive strains. Conclusions: This study reveals a novel regulatory switch where temperature, calcium, and pYV modulate biofilm formation in Y. enterocolitica. These findings suggest that Y. enterocolitica can adapt between motility- and EPS-dominated biofilm strategies depending on environmental conditions. Understanding these mechanisms offers potential targets for controlling biofilm-related persistence in clinical and food safety contexts. Full article