Search Results (1,668)

The detection of plastic explosives in vapor form is extremely challenging due to the very low volatility of their primary components, such as RDX and PETN. To overcome this limitation, volatile chemical markers like 2,3-dimethyl-2,3-dinitrobutane (DMNB) are added to explosive formulations to enable indirect vapor detection. This study presents a rapid method for detecting and quantifying DMNB vapors using a handheld ion mobility spectrometer (IMS) operating near ambient temperature, ammonia-doped and equipped with a non-radioactive corona discharge ionization source. The instrument, model LCD-3.2E (Smiths Detection Ltd.), is based on a twin drift–cell time-of-flight configuration and simultaneously records ion mobility spectra in both positive and negative modes. DMNB generated distinct product ion peaks in both modes, with reduced mobility values (K₀) of 1.42 cm²V⁻¹s⁻¹ (positive) and 1.37 cm²V⁻¹s⁻¹ (negative). The method demonstrated high sensitivity, with limits of detection calculated at 1.4 ppb_v (10.2 × 10⁻³ mg m⁻³) in positive mode and 3.1 ppb_v (22.7 × 10⁻³ mg m⁻³) in negative mode. The IMS system provided rapid responses within seconds and covered a quantifiable concentration range of 5–3000 ppb_v, with saturation estimated to appear above approximately 5 ppm_v (36.6 mg m⁻³). The simultaneous dual-polarity response of the DT IMS enhances both the selectivity and reliability of identification. These findings confirm the capability of portable IMSs for fast trace vapor detection in DMNB, supporting its application in field-based screening scenarios such as luggage inspection or container interrogation, where indirect detection of plastic explosives is required. Full article

In this work, a hybrid polymer electrolyte integrating single- and dual-ion conducting systems was developed for lithium-ion batteries using bio-based materials, namely oleic-acid derivatives and epoxidized soybean oil, through an in situ polymerization process. The fixed FSI anions in LiEFSOA enhance the selectivity of Li⁺ transport, while the cross-linked network formed by ESO provides mechanical stability, and the LiFSI incorporated into the polymer matrix helps maintain sufficient overall ionic conductivity. In addition, the long C18 oleic chains increase the internal free volume of the matrix, thereby improving segmental mobility within the amorphous phase. The in situ polymerization inside the cell causes intimate interfacial contact between the electrode and electrolyte, achieving an ionic conductivity of 1.05 × 10⁻⁴ S cm⁻¹ at 30 °C. Electrochemical evaluation using LiFePO₄/FSOA-2/Li cells shows an initial discharge capacity of 149.09 mAh g⁻¹ and a capacity retention of 81.09% after 100 cycles, and the average coulombic efficiency was 99.62%, demonstrating that the designed FSOA electrolyte exhibits stable cycling performance and competitive capacity. Overall, the combination of eco-friendly materials and a hybrid ion transport strategy provides a promising platform for developing sustainable and high-performance polymer electrolytes for lithium-ion batteries. Full article

Autonomous mobile robots are transforming industries from e-commerce logistics to field exploration, but their effectiveness depends on onboard energy storage. This study addresses the challenge of selecting optimal battery technologies for autonomous mobile robots, balancing performance, energy efficiency, thermal stability, and cost across diverse applications. We focus on lithium-ion, lithium-polymer, and nickel-metal hydride batteries, the most common power solutions, each with distinct advantages and disadvantages in energy density, form factor, thermal stability, and cost. A dynamic modeling and simulation framework in MapleSim evaluated these chemistries under defined and representative operating conditions, tracking state of charge and temperature during charging and discharging. A Particle Swarm Optimization algorithm evaluated 37 battery configurations by thermal stability, energy efficiency, and cost across five use cases. Key results indicate that for logistics and warehousing, lithium nickel manganese cobalt oxide with graphite is optimal; for healthcare, lithium nickel manganese cobalt oxide with lithium titanate oxide excels; for manufacturing, lithium nickel cobalt aluminum oxide with graphite leads; for agricultural robots, lithium manganese oxide with graphite is best; and for exploration and mining, lithium iron phosphate with graphite is most reliable. These results provide a structured basis for battery selection, showing how simulation-driven, multi-criteria decision-making enhances energy management and operational reliability. Full article

Ion-adsorption rare earth element (REE) deposits represent strategic critical resources in China, which were traditionally considered to be predominantly hosted in granite weathering crusts. However, the recent discovery of new deposit types within the weathering crusts of shallow metamorphic rocks in South China has opened up novel exploration frontiers, while research on their metallogenic mechanisms remains insufficient. To elucidate the REE enrichment mechanisms in shallow metamorphic rock weathering crusts, this study focuses on the Getengzui ion-adsorption REE deposit in southern Jiangxi Province. Twenty-four samples were collected from the weathering crust profiles of the Qingbaikouan Shenshan and Kuli Formations. Multiple analytical approaches were employed, including major and trace element analysis, Chemical Index of Alteration (CIA), Base Leaching Index (BA), and quantitative evaluation of element mass transfer coefficients (τ). Trace element spider diagrams, REE distribution patterns, and A-CN-K diagram analysis were also utilized. The results reveal that the weathering crusts have progressed to the middle–late stage of chemical weathering. The average CIA value is 83 for the middle-upper part of the completely weathered horizon in the Kuli Formation. In contrast, for the completely weathered horizon in the Shenshan Formation, the value is 86. Intense chemical weathering has resulted in the near-complete decomposition of primary silicate minerals and extensive leaching of base cations. This progress has created an acidic pore water environment, which is critical for REE mobilization. REEs exhibit characteristics of in situ secondary enrichment, with significant enrichment of ΣREE in the middle-upper part of the completely weathered horizon. The peak τ(ΣREE) values reach 0.78 and 2.43 for the Kuli and Shenshan Formations, respectively. Apatite dissolution is identified as the primary source of REE ions. Differences exist in the geochemical mobility sequences of elements between the two formations. REE enrichment is controlled by multi-stage geochemical barriers, including an oxidation barrier and a clay adsorption barrier. The oxidation barrier preferentially fixes Ce⁴⁺, whereas the clay adsorption barrier serves as the dominant mechanism for large-scale REE enrichment. Parent rock lithology is the primary factor governing the efficiency, scale, and fractionation characteristics of REE enrichment. The Kuli Formation is favorable for forming the thick, large-scale orebodies enriched in light rare earth elements (LREEs). In the contrast, the Shenshan Formation tends to host higher-grade orebodies, characterized by a relatively balanced ratio of LREEs and heavy rare earth elements (HREEs). This study clarifies the main controlling factors for ion-adsorption REE mineralization in two shallow metamorphic rocks. It thereby provides a theoretical basis for future exploration. This framework is applicable to analogous REE resources within shallow metamorphic rock distributions across South China and nationwide. Full article

To explore the characteristic volatile compounds of ‘Hujing Milu’ peaches from different growing regions, headspace solid-phase microextraction coupled with gas chromatography–mass spectrometry (HS-SPME-GC-MS) and headspace gas chromatography–ion mobility spectrometry (HS-GC-IMS) were employed to analyze volatile components in samples from six production areas. A total of 73 and 56 volatile compounds were identified by HS-SPME-GC-MS and HS-GC-IMS, respectively. Quantitative analysis revealed that esters, aldehydes, and alcohols were the main contributors to the aroma profile, accounting for over 70% of the total relative content. Combined with chemometric analysis (VIP > 1 and OAV/ROAV > 1), 17 potential biomarkers were identified that can distinguish ‘Hujing Milu’ peaches from different regions, including ethyl acetate, hexanol, (E)-2-nonenal, and dihydro-β-ionone. Moreover, soil properties of these regions and their correlation with volatile compounds were analyzed to elucidate the formation mechanisms of characteristic aromas. The results showed that ethyl acetate exhibited a significant positive correlation with soil pH (r = 0.530, p < 0.05), whereas dihydro-β-ionone showed a significant positive correlation with soil organic matter (r = 0.587, p < 0.05) and available potassium (r = 0.830, p < 0.05). This study identified characteristic volatile compounds of ‘Hujing Milu’ peaches from different regions, providing a reliable technical basis for origin traceability and the enhancement of aroma quality in ‘Hujing Milu’ peaches. Full article

Background: Mass spectrometry (MS)-based immunopeptidomics has emerged as the gold standard for profiling HLA-bound peptides, yet detection remains challenging due to their non-tryptic nature, variable lengths, and lack of basic residues, which limit ionisation and fragmentation efficiency. Methods: To address these limitations, we investigated the impact of incorporating 5% dimethyl sulfoxide (DMSO) into LC-MS/MS mobile-phase buffers on immunopeptidomic workflows. Using B-lymphoblastoid cell lines expressing HLA class I and II alleles and elastase-digested HeLa lysates as a surrogate for non-tryptic peptides, we assessed peptide identification, ionisation efficiency, charge state distribution, and fragmentation quality. Results: DMSO significantly increased peptide identifications across all sample types, with gains of ~1.33 folds for HLA class I, ~1.55 folds for HLA class II, and ~1.24 folds for elastase digests. Improvements were systematic and reproducible, driven by enhanced electrospray ionisation, higher charge states, and superior MS2 spectral quality, evidenced by ~2-fold increase in b- and y-ion intensities. Importantly, DMSO did not introduce major sequence bias, preserving motif integrity and predicted binding characteristics. Conclusions: Overall, these findings establish DMSO as a robust additive for improving sensitivity and reliability in immunopeptidomics, particularly for low-input or clinically derived samples. Full article

Nutritionally crucial unsaturated fatty acids, especially rich in high omega-3 bonds, are very prone to oxidation. This phenomenon makes oxidation stability a substantial challenge in every formulation, especially those which contain or at some stage of preparation contain water. Bigels and emulgels, which represent promising structured lipid systems for replacing saturated and trans fats in food formulations, pose significant oxidative stability challenges. This review examines oxidation mechanisms in such biphasic systems. Oxidation in bigels and emulgels proceeds through both free-radical-mediated autoxidation and metal-ion-catalysed pathways, with the oil–water interface serving as the primary reaction zone where pro-oxidants concentrate, and lipid substrates become accessible. Structural configuration critically determines oxidative stability, following the sequence W/O bigel > bicontinuous bigel > O/W bigel. The high viscosity of gel matrices provides substantial protection by restricting radical mobility and oxygen diffusion. Mass transfer occurs via diffusion, collision–exchange–separation, and micelle-assisted mechanisms, with association colloids forming localized interfaces that accelerate oxidation. Thermal processing presents particular challenges, as temperatures above 50 °C disrupt most gel structures and accelerate oxidative degradation. Effective protective strategies include interfacial engineering with emulsifiers to reduce oil–water interfacial tension, incorporation of natural antioxidants (e.g., phenolic compounds and tocopherols), and synergistic antioxidant combinations. This review provides a mechanistic framework for formulating oxidatively stable bigels and emulgels suitable for food applications. Full article

Background: The visceral organs of sea cucumbers belonging to the family Stichopodidae, also known as Stichopodidae Viscus (SV), have been traditionally used for the management of gastrointestinal disorders. Experimental evidence has shown that the ethanol extract of SV (SVE) alleviates ulcerative colitis (UC) symptoms in a mouse model. However, the chemical constituents of SVE and the potential molecular targets mediating its effects in UC remain unclear. Methods: In this study, SVE was prepared from Apostichopus japonicus (Selenka). A reliable and sensitive strategy integrating advanced analytical and informatics tools was employed to profile the chemical components of SVE. Analyses were performed using ultra-performance liquid chromatography coupled with ion mobility spectrometry and quadrupole time-of-flight mass spectrometry operating in high-definition MS^E (UPLC-IMS-Q-TOF-HDMS^E), with data processed using the UNIFI scientific information system. Constituent identification relied on retention time (RT), accurate mass (MS1), experimentally acquired HDMS^E (MS2) spectra, and collision cross-section (CCS). Metabolomics-based approaches were further applied to characterize the in vivo exposure profile of SVE components in mouse serum and colon tissue after oral administration. Subsequently, the putative bioactive constituents and their underlying mechanisms of action were investigated using network pharmacology and molecular docking. Results: Based on the integrated identification strategy, a total of 78 compounds, including saponins, phenolic acids, fatty acids, and amino acids, were annotated in SVE, among which 6 compounds were verified using authentic reference standards to ensure unambiguous identification. Subsequently, 35 features in serum and 24 in the colon were found to be significantly altered following a single oral dose of SVE in mice, and were defined as SVE-related differential constituents. After network pharmacology analyses, 129 shared targets were identified between potential targets of SVE-related components in serum and UC-related targets, including PIK3CA, EGFR, and AKT1. Functional enrichment analysis suggested that SVE might exert its effects in UC through modulation of key nodes within the PI3K-Akt and EGFR signaling pathways, as well as lipid- and atherosclerosis-related pathways. Molecular docking results further indicated moderate binding affinities of representative SVE-related differential components toward PIK3CA, AKT1, and EGFR. Conclusions: This study clarifies the chemical basis and potential UC-related mechanisms of SVE, providing a scientific rationale for the development of SV-derived therapeutic candidates for UC. Full article

The pursuit of high-energy-density cathode materials has positioned LiNiO₂ as a promising candidate due to its high theoretical capacity. However, its practical application is hindered by structural instability, cation mixing, and sluggish Li-ion mobility. This study presents a strategic co-doping approach to enhance the electrochemical performance of R3m-structured LiNiO₂ by introducing Na at the Li site and Nb/Al/W at the Ni site. First-principles calculations based on density functional theory (DFT), combined with the bond valence sum energy (BVSE) method, were employed to evaluate the structural, electronic, and transport properties of the doped systems. The optimized lattice parameters reveal that co-doping induces lattice expansion and suppresses cation disorder, thereby improving structural integrity. Formation energy validates the thermodynamics of the modified structures. Furthermore, BVSE-based ion migration mapping shows that Na/Nb and Na/Al co-doping significantly broadens Li-ion diffusion pathways and lowers migration barriers compared to pristine LiNiO₂. These results demonstrate that dual-site doping is an effective strategy to overcome intrinsic limitations of Ni-rich layered oxides, offering a rational design route cathode for next-generation Li-ion battery. Full article

Electric vehicles (EVs) represent a key pathway toward reducing greenhouse gas emissions and fossil fuel dependence. Although significant advances have been achieved in energy storage technologies for EVs, a structured comparative assessment that jointly evaluates batteries, supercapacitors, and their hybridisation remains lacking. This review addresses that gap by systematically comparing lithium-ion, lead-acid, and nickel-based batteries with electrochemical double-layer capacitors (EDLCs), pseudocapacitors, and hybrid capacitors across ten performance and sustainability criteria. A literature-informed scoring framework, supplemented by sensitivity analysis under alternative weighting scenarios, is employed to rank the technologies. Particular attention is given to Hybrid Energy Storage Systems (HESS), which combine the high energy density of lithium-ion batteries with the high power density and long cycle life of supercapacitors. The review synthesises evidence that HESS can improve overall energy efficiency by up to 20% and extend battery lifetime by 30–50%, thereby reducing raw-material extraction, electronic waste, and lifecycle cost. Second-life pathways and circular-economy implications are discussed in depth. The findings demonstrate that neither batteries nor supercapacitors alone can satisfy the full spectrum of EV energy demands; instead, their integration within HESS offers the most balanced, sustainable, and economically viable solution. This work provides actionable insights for engineers, policymakers, and stakeholders engaged in next-generation sustainable mobility. Full article

Sustainable food production systems based on the use of biofertilizers and soil improvers are proposed to mitigate agricultural-related environmental impacts and address the climate crisis. In particular, plant growth-promoting microbes (PGPM) and biochar (Char) have been reported to improve plant growth, soil quality, and crop yield; however, their effects on food quality remain debated. In this study, untargeted metabolomics based on ultra-high performance liquid chromatography–ion mobility–high-resolution mass spectrometry (UHPLC-IMS-HRMS) and proton nuclear magnetic resonance spectroscopy (¹H-NMR) are proposed to achieve a comprehensive investigation of the effects of Char, PGPM and Char+PGPM on durum wheat. A total of 88 metabolites were annotated by UHPLC-IMS-HRMS, mainly belonging to carbohydrates, flavones, flavonoids, glycerophospholipids, and glycolipids, while 30 compounds were annotated by ¹H-NMR, mostly amino acids and short-chain carboxylic acids. The two datasets were merged with the gluten protein content dataset by using low- and mid-level data fusion approaches, obtaining models that exhibit excellent classification performance. Integrated analysis highlighted that the combined Char+PGPM treatment induced metabolic changes across multiple chemical classes, including enrichment of flavonoids and lipids, and downregulation of carbohydrate metabolites, suggesting a redistribution of carbon resources and modulation of secondary metabolism with potential implications on wheat grain quality. Full article

Cellulose and hemicellulose, both widely present in radioactive waste, undergo combined radiolytic and hydrolytic degradation during disposal under the highly alkaline conditions imposed by the cementitious waste matrices and engineered barriers. This combined process generates water-soluble organic compounds that can complex with radionuclides, thereby potentially enhancing their migration from the waste to the biosphere. Identification of these degradation products formed by cellulosic materials is essential for assessing their complexation potential and predicting their impact on radionuclide mobility. In this work, degradation products resulting from sequential radiolytic and alkaline degradation of cellulosic tissues, realistically present in radioactive waste, were identified using multiple advanced techniques, i.e., Electrospray Ionization Time-of-Flight Mass Spectrometry, Ion Chromatography Mass Spectrometry, and Nuclear Magnetic Resonance spectroscopy. Our results confirm that isosaccharinic acid (α-ISA and β-ISA) is the major end product from cellulose degradation, while xylo-isosaccharinic acid (XISA) indicates hemicellulose degradation. Furthermore, significant concentrations of formic and lactic acid were detected, alongside minor products including glycolic, acetic, propionic, malonic, and oxalic acids, with malonic and oxalic acids appearing only after irradiation at high irradiation doses and under air (malonic) or argon (oxalic). Additional unquantified compounds, such as glutaric acid, 2-hydroxybutyric acid, and oligosaccharides, were observed as well. These findings advance our insight into the degradation of end products of cellulosic materials in radioactive waste and establish a foundation for future research on their complexation potential and impact on radionuclide mobility, especially for compounds where data are lacking. Full article

This study systematically investigates the reaction characteristics of laminated shale oil reservoirs in the 7₃ sub-member of the Yanchang Formation, Heshui area, Ordos Basin, under exposure to CNI-I nanoviscous fracturing fluid. The reservoir matrix comprises 84.85% brittle minerals and 15.15% clay minerals. Fluid–rock interactions significantly dissolve calcite and dolomite, releasing Ca²⁺ and Mg²⁺ ions, while clay mineral reactions liberate substantial amounts of Na⁺. Post-reaction, fluid system stability is markedly reduced, elevating the risk of precipitate formation and pore-throat plugging. Exposure to fracturing fluid reduces the T₂ cutoff value of core samples from 3.29 ms to 1.72 ms, indicating a densification of the micro-pore-throat network and a decline in mobile fluid saturation, while fracture apertures exhibit widening. Based on empirical data, a discriminant criterion (R value) defined as the ratio of fracture aperture increment rate to pore-throat diameter reduction rate is established at 1.25, confirming that fracture propagation dominates over pore constriction. Dual-medium modeling yields a net permeability enhancement of 19.35%. Fluid–rock interactions induce overall degradation of rock mechanical properties with pronounced anisotropy: rock strength along the direction perpendicular to bedding declines by 37.546%, Young’s modulus decreases by 1.81%, and Poisson’s ratio increases by 0.02%—all significantly exceeding the degree of degradation parallel to bedding. This anisotropic mechanical degradation predisposes the near-wellbore region to shear slip and wall spalling, prompting the development of targeted engineering mitigation strategies. Full article

Fly ash (FA) captures most mercury (Hg) in the waste stream during municipal solid waste incineration (MSWI), and the content and speciation of Hg in MSWI fly ash (MSWI-FA) have a significant impact on the ecological environment. In this study, 245 fly ash samples were collected from 18 MSWI facilities in Guizhou Province, a fragile karst area with a high Hg background in Southwest China. The results indicate that total Hg ranged from 0.52 to 444 mg/kg among samples, while the geometric means varied from 0.85 to 223.33 mg/kg for different incinerators, with a weighted geometric mean of 22.14 mg/kg, more than double the national average. Substantial temporal variability in Hg content suggested intermittent inputs of Hg-rich waste into the MSW stream. While positive correlations (p < 0.05) were observed between Hg and chlorine, potassium, and cadmium, the moderate to low R² values indicate that Hg enrichment is a complex multi-factor system influenced by heterogeneous waste compositions and transient thermochemical conditions. Speciation analysis revealed that most of the Hg exists in its elemental form (F4), constituting over 80% of the total Hg. However, the water-soluble fraction (F1) and the ion-exchangeable fraction (F2) each reached up to 26–29% in some samples, indicating substantial environmental mobility. These findings demonstrate that MSWI-FA in Guizhou contains elevated Hg levels, posing considerable ecological and environmental risks. Enhancing the classification and management of Hg-containing waste in MSW is critical to mitigating the environmental risks of fly ash, particularly in karst ecological areas. Full article

Photo-thermo-refractive (PTR) glass is a key material for optical devices, yet the synergistic mechanism between its raw material precursors remains unclear. This study systematically investigates the individual and combined effects of silver precursors (Ag₂O and AgNO₃) and sodium salts (Na₂CO₃ and NaNO₃) on the structural evolution and crystallization behavior of Si-Na-Al-Zn-based PTR glasses. Through a combination of spectroscopic (UV-Vis, FTIR, Raman), thermal (DSC), and microscopic (SEM) characterizations, we demonstrate that the precursor combination profoundly influences the glass network homogeneity, ion mobility, and phase separation behavior. The results reveal that the AgNO₃ and NaNO₃ combination fosters a highly homogeneous and thermally stable network, facilitating the formation of a uniform distribution of silver nanoparticles and, subsequently, a dense nanoscale precipitation of NaF crystals. This work elucidates the critical synergistic mechanism between precursors, providing a fundamental basis for the precise composition design of high-performance PTR glasses for advanced optical applications. Full article