Search Results (4,006)

Background: Buddleja globosa Hope (matico) is a Chilean medicinal plant traditionally used in Mapuche and Aymara ethnomedicine. However, no systematic synthesis of its phytochemical composition and pharmacological evidence has been previously reported. Methods: A PRISMA 2020-compliant systematic review was conducted using Google Scholar, PubMed, EBSCOhost, and Springer Nature databases from inception to March 2026. Studies reporting phytochemical characterization and/or biological activities of B. globosa were included. Methodological quality was assessed using an adapted five-criterion tool for non-clinical studies. The protocol was registered in OSF. Results: Fourteen studies (1989–2026), mainly from Chilean research groups, identified 27 bioactive compounds across leaves, roots, and flowers. These included phenylethanoid glycosides (e.g., verbascoside/acteoside, echinacoside, forsitoside B, and linarin), flavonoids (luteolin 7-O-glucoside, apigenin 7-O-glucoside, myricetin, catechin, and epicatechin), pentacyclic triterpenes (α/β-amyrins and β-sitosterol), iridoid glycosides, and clerodane diterpenoids (buddledines A–C), as well as four newly reported phenylethanoids. Antioxidant activity was the most frequently evaluated endpoint (11/14 studies), mainly mediated through hydrogen atom transfer and single-electron transfer mechanisms linked to caffeoyl and flavonoid structures. Anti-inflammatory effects (five studies) involved COX and 5-LOX inhibition and reduced PGE₂ production in LPS-stimulated macrophages. Additional reported activities included antihepatotoxic, antiplatelet, wound-healing, antibacterial, and antifungal effects. Conclusions:B. globosa exhibits a coherent phytochemical profile supporting strong preclinical antioxidant and anti-inflammatory activities. The main limitation for clinical translation is the low oral bioavailability of phenylethanoid glycosides. Nanoformulation strategies, investigation of colonic metabolites, and topical delivery systems represent promising approaches to bridge the preclinical-to-clinical gap. Full article

Sustainable water remediation requires catalytic strategies that remove contaminants efficiently while reducing chemical input, byproduct formation, and ecological disturbance. Conventional radical-dominated advanced oxidation processes can rapidly degrade pollutants, but their reliance on high oxidant dosages and freely diffusing reactive oxygen species often causes matrix quenching, non-selective oxidation, low oxidant utilization, and potential ecological risks. Mild interfacial catalysis provides a materials-chemistry strategy to regulate oxidative intensity and direct contaminant transformation under environmentally relevant conditions. In this review, mild catalysts are defined by pathway-selective, interfacially confined, and environmentally compatible oxidation rather than by low dosage alone. Representative non-radical or low-intensity pathways, including singlet oxygen generation, surface-mediated electron transfer, high-valent metal–oxo species, and direct oxidative transfer processes, are discussed in relation to active-site structure, oxidant utilization, matrix tolerance, and byproduct control. We further summarize how coordination environments, defect chemistry, heteroatom configurations, nanoconfinement, and immobilized interfaces regulate reactive-species formation and interfacial charge transfer. Key material platforms, including single-atom catalysts, heteroatom-doped carbons, defect-engineered oxides, catalytic membranes, hydrogels, and floating or immobilized composites, are evaluated from mechanistic and application-oriented perspectives. Finally, catalyst regeneration, cost, microbial community responses, algae–bacteria balance, ecotoxicity, and long-term safety are discussed to guide sustainable aquatic ecosystem restoration. Full article

Although garnet-type Li₇La₃Zr₂O₁₂ (LLZO) solid electrolytes are promising candidates for high-energy-density all-solid-state batteries, their practical applications are limited by high-voltage oxidation instability and interfacial degradation. To address these limitations, Al-doped LLZO (Al-LLZO) solid electrolytes were synthesized via a conventional solid-state reaction method, and the effects of PE-ALD-derived Al₂O₃ nanocoatings on electrochemical properties and interfacial stability were investigated. Al₂O₃ nanocoatings with different structures (5 and 10 nm single-side, and 5 nm double-side) were deposited on Al-LLZO pellets using plasma-enhanced atomic layer deposition. The Al₂O₃ coating reduced electronic conductivity by approximately one order of magnitude while maintaining similar ionic conductivity. Linear sweep voltammetry revealed that initial oxidation onset voltage increased from ~4.2 V (bare Al-LLZO) to ~5.0 V (5 nm-coated samples), while the 10 nm-coated sample exhibited the most delayed anodic current response (~5.2 V). The 5 nm double-side coated sample showed the best Li plating/stripping stability with a critical current density of 1.10 mA/cm² and stable long-term galvanostatic cycling behavior over 200 h at 0.05 mA/cm². Thus, ALD-based Al₂O₃ interfacial engineering can simultaneously improve the high-voltage oxidation and Li metal interfacial stabilities of garnet-type Al-LLZO solid electrolytes for practical all-solid-state batteries. Full article

Bisphenol A type epoxy resin has the problem of relatively high brittleness after curing. Although traditional polysiloxane toughening methods can improve toughness, they often come at the expense of strength. In this paper, methylphenyl dimethoxysilane (MPS) was used as a monomer to synthesize end-hydroxyl poly(methylphenyl)siloxane (PMPS), which was then used to modify E51 epoxy resin. The structure and reaction degree were characterized by infrared spectroscopy, proton nuclear magnetic resonance spectroscopy, matrix-assisted laser desorption/ionization time-of-flight/time-of-flight mass spectrometry and viscosity tests. The mechanical test results show that when the PMPS content is 20 wt%, the tensile, flexural, compressive and impact strengths of the modified resin increase by 31.26%, 26.16%, 18.53% and 98.66%, respectively, compared with the unmodified resin, and the tensile and flexural elastic moduli increase by 38.36% and 32.25%, respectively. The fracture toughness increases by 60.29%, indicating that the strength, stiffness and toughness of the material have all been improved. Dynamic mechanical analysis shows that the glass transition temperature and crosslinking density of the system gradually decrease with increasing PMPS content. Thermogravimetric analysis shows that the introduction of PMPS increases the char yield and decreases the maximum thermal decomposition rate, thereby enhancing the thermal stability of the system. Microscopic morphology analysis by optical microscopy, scanning electron microscopy and atomic force microscopy shows that the system has good compatibility, and the internal different modulus phases are distributed in a network-like manner, forming a uniform co-continuous or bicontinuous phase structure. This structure effectively promotes stress transfer and energy dissipation, alleviates local stress concentration, and thus comprehensively improves the mechanical properties of the resin system. Full article

Two-dimensional (2D) materials have emerged as a key platform for next-generation electronics due to their atomic thickness and tunable properties. Iron disulfide (FeS₂), known as pyrite, with a bandgap of ~0.95 eV, is suitable for solar energy applications. However, its performance is limited by defects in bulk crystals. Reducing FeS₂ to a single layer eliminates bulk defects and enables strain engineering of the bandgap. In this study, First-principles density functional theory (DFT) calculations are performed using the CASTEP code and the PBEsol functional to examine the structural, electronic, and optical properties of a distorted 1T′-phase FeS₂ monolayer. Full geometry optimization yields lattice parameters a′ = 17.594 Å, b′ = 3.20231 Å, c′ = 5.28091 Å, and Fe–S bond angles of ~75.8° and ~98.2°, confirming symmetry-breaking distortion. The monolayer is dynamically stable, showing no imaginary modes in the phonon dispersion, and remains structurally intact up to 1000 K in molecular dynamics simulations. The unstrained system has an indirect bandgap of 0.70 eV, with the valence band maximum at the Γ point (dominated by S-p states) and conduction band minimum near the X point (Fe-d states). Under mechanical strain (±4%), the bandgap decreases significantly: from 0.70 eV to 0.44 eV under +4% tensile strain along the y-axis, and to 0.53 eV under −4% compressive strain. Biaxial strain causes weaker modulation, reducing the gap to 0.66 eV (+4%) and 0.62 eV (−4%). Optical absorption exceeds 10⁴ cm⁻¹ for photon energies above the bandgap, with tensile strain causing redshifts and compressive strain inducing blueshifts. These findings demonstrate that 2D FeS₂ is mechanically robust, electronically tunable, and optically active, making it a promising candidate material for flexible strain sensors and photovoltaic devices. This work is intended to motivate and inform future synthesis efforts. Full article

Electron configurations are known to provide valuable insights into the electronic structure and behavior of atoms. They specify which and how the electronic (sub-) shells are occupied, and are thus an essential ingredient for most atomic observables. When combined with the shell model and the successive filling of shells, these configurations help explain the Periodic Table and much of chemical binding. They also establish a qualitative framework for analyzing excitation, ionization and relaxation processes and may facilitate a wide range of astrophysical and plasma simulations. Here, we review the role of electron configurations for understanding atomic behavior in interactions with particles and radiation. In particular, we identify several central requirements for an efficient treatment of configuration lists and define a domain-specific language in order to generate, manipulate and analyze such lists as well as to extract physically relevant information. We also demonstrate the implementation of this language in Jac, the Jena Atomic Calculator. An efficient handling of configurations will refine the coupling of structure codes with the spectral synthesis of plasma radiation, the setup of ionic cascades or even non-LTE plasma simulations. This common framework for dealing with electron configurations therefore improves consistency, reproducibility and scalability of atomic modeling. Full article

High-sensitivity detection of formaldehyde is critically important for environmental protection and public health. Zinc oxide (ZnO) is a widely used core material for chemiresistive gas sensors; however, its conventional low-index facets suffer from a limited number of active sites, creating a bottleneck for further sensitivity enhancement. To overcome this limitation, this study pioneers the application of the highly reactive ZnO $\left[20\overline{2}1\right]$ high-index polar surface for formaldehyde detection. By leveraging its unique stepped atomic configuration and unprecedented density of coordination-unsaturated active sites, we systematically investigate the formaldehyde adsorption behavior and the underlying sensing mechanism using first-principles calculations based on density functional theory (DFT). The pristine ZnO $\left[20\overline{2}1\right]$ surface exhibits intrinsic metallic character. At a coverage of 1 monolayer (ML), the most stable G1 configuration achieves an adsorption energy of −1.54 eV per CH₂O molecule. Within a 2 × 1 supercell, formaldehyde adopts both associative and dissociative adsorption modes. At a lower coverage, formaldehyde forms a stable bidentate structure through dual C–O and Zn–O bonding interactions. Electronic structure analysis reveals significant orbital hybridization and interfacial charge redistribution upon adsorption. Notably, associative adsorption opens a bandgap of 0.04 eV at the Fermi level, inducing a metal-to-semiconductor transition. In contrast, dissociative adsorption results in pronounced n-type doping, thereby elucidating the microscopic origin of the resistivity decrease observed in ZnO-based sensors. Overall, this work highlights the structural advantages of high-index facets and demonstrates for the first time the superior formaldehyde adsorption capability of the ZnO $\left[20\overline{2}1\right]$ facet, providing robust theoretical guidance for the rational design of next-generation, high-performance gas-sensing materials. Full article

Demand for greener and safer chemistries has driven the innovation of bioinspired and enzyme-mimicking catalysts for selective and efficient oxidation and hydrogenation under mild conditions. Natural catalysts, including peroxidases, oxidases, hydrogenases, oxygenases and dehydrogenases, boast remarkable activity, specificity, stability, selectivity, low energy requirements and atom economy. Disadvantages of enzymes, such as poor thermal stability, a narrow operational range, low recovery yield and the expense of purification, are motivating the discovery and design of enzyme substitutes. Several artificial platforms have appeared recently: nanozymes, artificial metalloenzymes, biomimetic metal Complexes, MOFs, atomic catalysts, bioinorganic hybrid systems, among others. These systems aim to replicate key structural and mechanistic features of enzymes while providing greater operational stability, recyclability, and scalability. Recent work has demonstrated the benefit of enzyme mimics in increasing eco-sustainability in reactions such as alcohol oxidation, selective alkane oxidation, waste degradation, catalytic photooxygen activation and biomass waste conversion. Similarly, biomimetic hydrogenation catalysts have shown outstanding activity in asymmetrically hydrogenating chemicals, reducing CO₂ into chemicals, hydrogenation by hydrogen transfer and creating hydrogen through water. Through control of active sites, second coordination sites, defects and electrons/protons in the system, significant gains have been seen in reaction selectivity and frequency of turning over substrate into product. Nanozymes, biohybrid catalysis and artificial catalysts guided by deep learning are further broadening the applications of biomimetic catalysis in oxidation and hydrogenation. The article review aims to provide a summary of the most current progress with bioinspired and enzyme-mimicking catalysts, focusing on catalytic mechanisms, how to design such catalysts, how green chemistry benefits from their development and where further application is likely in the coming years. Full article

Focused-ion-beam scanning electron microscopy (FIB-SEM) provides site-specific access to buried interfaces, particle interiors, porous electrode architectures, and localized degradation regions in energy materials. This capability is particularly valuable for rechargeable batteries, solid-state ion conductors, alkali-metal electrodes, and reactive solid–liquid interfaces, where the structures governing transport and failure are rarely exposed at a free surface. However, the preparation and imaging steps that reveal these regions may also alter them. Ion milling, environmental transfer, vacuum exposure, scanning electron microscopy (SEM), cryogenic handling, transmission electron microscopy (TEM), scanning transmission electron microscopy (STEM), energy-dispersive X-ray spectroscopy (EDS), electron energy-loss spectroscopy (EELS), and atom probe tomography (APT) can each modify local morphology, chemistry, or phase state. These effects are especially important when the intended evidence involves light elements, metastable phases, nanoscale coatings, reactive interphases, volatile species, or ion-conducting materials. This perspective develops a claim-specific framework for evaluating such results. Preparation- and imaging-induced changes are related to the material feature being interpreted and to the minimum control needed to distinguish the two origins. For porous electrodes, the relevant outputs include pore volume, connectivity, tortuosity, crack geometry, phase fraction, and active surface area. For reactive interfaces and solid electrolytes, the critical questions concern alkali-metal redistribution, surface amorphization, light-element contrast, implanted-species chemistry, and beam-induced phase formation. The discussion further compares conventional Ga-FIB, cryogenic FIB, Xe plasma FIB, low-energy Ar+ polishing, broad-ion-beam preparation, ultramicrotomy, and repeated particle-oriented FIB workflows. Reliable interpretation requires the preparation route, transfer conditions, imaging dose, analytical acquisition, and claim-specific controls to be reported together with the final microscopy result. Full article

Nanoemulsions are thermodynamically unstable but kinetically stable colloidal dispersion systems with droplet sizes ranging from 20 to 500 nm. With their high specific surface area, excellent optical properties, tunable rheology, and remarkable penetration ability, these systems demonstrate enormous potential in enhanced oil recovery (EOR). This paper systematically reviews the significant advances in nanoemulsion characterization techniques and oil displacement mechanisms. The nanoemulsion characterization techniques are examined, covering a comprehensive multi-scale characterization system from particle size and distribution analysis (e.g., dynamic light scattering, laser diffraction), micro-morphology and structure visualization (e.g., transmission electron microscopy, atomic force microscopy), and interface and surface property characterization (e.g., interfacial tension measurement, zeta potential analysis) to stability and rheology assessment, as well as chemical composition and structure analysis. Furthermore, core mechanisms of nanoemulsions in oil displacement processes are briefly summarized, revealing multiple synergistic enhancement mechanisms including ultra-low interfacial tension and oil film stripping, rock wettability alteration, emulsification and viscosity reduction, improved fluid flow and injection pressure reduction. Finally, prospects for the potential application of nanoemulsion oil displacement technology in the development of low-permeability, tight, and heavy oil reservoirs are described by analyzing the current challenges such as unclear structure–activity relationships, full-chain stability (including storage, transport, injection, and reservoir aging), and environmental safety, and future research directions are pointed out, including clarifying structure–activity relationships, smart responsive system development, artificial intelligence-assisted design, and pilot-scale validation. Clarifying the link between nanoemulsion characterization techniques and oil displacement mechanisms is of significant academic and engineering value for promoting the transition from empirical application to rational design of related technologies. Full article

Aqueous zinc–iodine batteries (AZIBs) are emerging as highly promising candidates for next-generation, grid-scale energy storage due to the intrinsic safety of water-based electrolytes, the high theoretical capacity of the zinc anode, and the rapid conversion kinetics of the iodine cathode. However, the practical commercialization of AZIBs is severely impeded by formidable interfacial instabilities, including the uncontrollable growth of zinc dendrites, parasitic hydrogen evolution reactions (HER), and the notorious polyiodide (I₃⁻, I₅⁻) shuttle effect. These macroscopic degradation modes are fundamentally rooted in the robust [Zn(H₂O)₆]²⁺ primary solvation sheath and the immense thermodynamic driving force for polyiodide dissolution in highly polar aqueous media. To address these interconnected challenges, electrolyte engineering has evolved into the most potent, holistic strategy. This comprehensive review systematically evaluates the latest advancements in electrolyte engineering for AZIBs. We first deeply decipher the fundamental thermodynamic mechanisms governing Zn²⁺ desolvation and iodine multiphase conversion. Subsequently, we critically analyze cutting-edge regulation paradigms, including water-in-salt (WIS) and localized high-concentration electrolytes (LHCE), cosolvent networks, functional molecular additives, deep eutectic solvents (DES), and quasi-solid-state hydrogels. By integrating in situ/operando spectroscopic characterizations with multiscale theoretical computations (such as MD and DFT), we elucidate the structure–activity relationships at the atomic level. Finally, we provide strategic perspectives on the future trajectories of the field, emphasizing the stabilization of multi-electron (I⁻/I⁰/I⁺) halogen chemistry, AI-driven high-throughput screening, and the rigorous standardization of Ah-level pouch cell engineering for extreme-environment applications. Full article

Steric effects refer to the effect of the size and spatial arrangement of atoms or groups on the reactions, interactions, and catalytic activities of molecules. The incorporation of Cl (chlorine) and Br (bromine) atoms as substituents into phthalocyanine (Pc) structures can have important catalytic effects. These effects arise mainly from their electronic and steric properties, which influence the behavior of the central metal ion and the overall catalyst performance. In this work, Co(II)PcQBr₂ was synthesized and characterized by spectral techniques. The catalytical activity of Co(II)PcQBr₂ was then evaluated for the oxidation of benzyl alcohol. The effects of the substrate/catalyst ratio, oxidant/catalyst ratio, oxidant type and temperature on the oxidation reaction of benzyl alcohol were investigated. Both catalysts exhibited high TON, TOF and total conversion yields in the presence of H₂O₂ as the oxidant at 50 °C. (substrate/oxidant/catalyst:1000/500/1). When the total product conversions were calculated for both catalysts, Co(II)PcQBr₂ was found to have a lower product conversion (88.7%, with a TON of 914 and a TOF of 457 ) than Co(II)PcQCl₂. Moreover, Co(II)PcQCl₂ was determined to have higher selectivity of benzyl benzoate (94.0%, with a TON of 940 and a TOF of 470 ). The larger size of the Br atom compared to that of the Cl atom was observed to reduce catalytic activity. Considering the size of the Cl atom, it was concluded that steric effects favor the formation of benzyl benzoate by inhibiting possible side reactions, thus increasing the catalytic activity. Full article

Background/Objectives: Lipid-based nanocarriers have emerged as promising systems for improving the delivery of poorly soluble drugs by enhancing stability, bioavailability, and controlled release. This work aimed to formulate solid lipid nanoparticles (SLN) and nanostructured lipid carriers (NLC) containing ciprofloxacin (CIP) using solvent-free procedures. Methods: The systems were extensively characterized using dynamic light scattering (DLS), transmission electron microscopy (TEM), and atomic force microscopy (AFM) to study the nanoparticles in the solid state. Furthermore, in vitro drug release was evaluated, and mathematical modeling was applied to analyze the resulting release kinetics. Additionally, storage stability was assessed at 4 °C and 25 °C over a period of 8 months. Results: The results indicated that SLN with an average size of ~50 nm (SLN 50) and NLC with mean diameters of ~25, 50, and 100 nm (NLC 25, NLC 50 and NLC 100 respectively) were successfully prepared. DLS measurements showed narrow particle size distributions (PdI ≤ 0.2) and negative zeta potentials ranging from −3.7 to −7.7 mV. Encapsulation efficiencies were remarkably high for most systems, reaching ~98% for SLN 50, NLC 50, and NLC 100, while the smallest formulation (NLC 25) showed a lower efficiency (~80%). Both TEM and AFM confirmed the formation of spherical nanoscale structures consistent with the sizes determined by DLS. Release studies revealed a strong influence of particle size on kinetics: NLC 25 exhibited rapid release (~95% within 30 min), whereas NLC 100 showed a sustained profile (<20% after 6 h). Dissolution profiles were accurately described by the Lumped-Gonzo kinetic model (R² > 0.98), enabling estimation of dissolution efficiency. Conclusions: These findings confirm that lipid-based nanocarriers can be engineered to precisely control CIP release. Full article

Ready-to-eat sea cucumbers (RSC) cannot be preserved at room temperature due to autolysis, which is closely related to the instability of collagen resulting from the disruption of hydrogen bonds. To investigate the protective effect of N-(3-Dimethylaminopropyl)-N′-ethylcarbodiimide hydrochloride/N-hydroxysuccinimide (EDC/NHS) cross-linking against disruption of hydrogen bonds and its role in stabilizing RSC quality at room temperature, this study designed comparative experiments involving EDC/NHS cross-linking treatments with varying sequences of hydrogen bonds disruption. The results indicated that EDC/NHS positively affects the stabilization of the collagen structure in RSC. The various quality parameters of both groups of RSC that underwent cross-linking treatment before and after hydrogen bonds disruption were significantly better than those of the control group, which only experienced the breaking of hydrogen bonds. Notably, the Eb group, which underwent EDC/NHS cross-linking treatment prior to the disruption of the hydrogen bonds network, yielded even more favorable results. Preliminary analyses of textural properties and moisture content suggested that EDC/NHS helps delay the deterioration of RSC quality. The levels of soluble components and carbonyl groups indicated that prior cross-linking treatment is more effective in mitigating collagen degradation and oxidation. Differential scanning calorimetry revealed that the reduction in ΔH for the Eb group was only 2.4%. Furthermore, fluorescence spectroscopy, Fourier transform infrared spectroscopy, and circular dichroism spectroscopy, examined from the perspectives of secondary and tertiary structures respectively, indicated that the cross-linking mechanism of EDC/NHS involves the formation of a more robust network of amide bonds, thereby preventing the disruption of hydrogen bonds and enhancing collagen stability, enabling it to better resist the cleavage of hydrogen bonds due to urea. The scanning electron microscope and Van Gieson’s staining techniques offer a clearer illustration of this point from a microscopic perspective. Moreover, molecular docking simulations have indicated the cross-linking mechanism of EDC/NHS at the atomic level, thereby establishing a scientific foundation for the potential application and development of EDC/NHS in room-temperature storage technologies for RSC. Full article

Tellurium (Te), an attractive p-type van der Waals semiconductor, has been considered a promising candidate in electrical applications due to its unique one-dimensional chiral atomic-helical-chain structure, tunable bandgap, and ultrahigh hole mobility. This review summarizes recent advances in the controlled synthesis of Te semiconductor nanostructures, including one-dimensional tellurium nanowires and two-dimensional tellurene in the form of nanosheets and thin films. We further highlight emerging electrical applications of Te in field-effect transistors, logic circuits, photodetectors, memristors, and artificial synapse devices. Finally, current challenges and future opportunities for the commercialization of Te-based electronic and optoelectronic devices, particularly for neuromorphic and in-sensor computing systems, are discussed. Full article