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Keywords = volatile fractions

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20 pages, 3043 KB  
Article
Experimental Study on Element Release and Conversion of High-Alkali Coal via Fluidized Preheating
by Shengbo Jia, Jianguo Zhu, Meiheriayi Mutailipu, Yu Huang, Jingzhang Liu and Qinggang Lyu
Energies 2026, 19(3), 691; https://doi.org/10.3390/en19030691 - 28 Jan 2026
Viewed by 80
Abstract
The Zhundong coalfield in Xinjiang contains vast reserves and is a crucial source of thermal coal. However, the Zhundong coal has a high content of alkali and alkaline earth metals, which makes it prone to ash deposition and slagging in boilers, thereby limiting [...] Read more.
The Zhundong coalfield in Xinjiang contains vast reserves and is a crucial source of thermal coal. However, the Zhundong coal has a high content of alkali and alkaline earth metals, which makes it prone to ash deposition and slagging in boilers, thereby limiting its large-scale utilization. Fluidized-bed preheating is an emerging clean combustion technology that can reduce the slagging and fouling risks associated with high-alkali coal by modifying its fuel properties. This study employs circulating fluidized-bed preheating technology to treat high-alkali coal, with a focus on investigating the effect of the preheated air equivalence ratio on fuel preheating modification. Through microscopic characterization of both the raw coal and preheated char, the release and transformation behaviors of elements and substances during the preheating process are revealed. The results demonstrate that fluidized preheating promotes alkali metal precipitation, and increasing the preheated air equivalence ratio (λPr) enhances gas production and elemental release, with a volatile fraction mass conversion of up to 84.57%. As the λPr value increased from 0.28 to 0.40, the average temperature in the preheater riser increased from 904 °C to 968 °C. Compared to the raw coal, the specific surface area of the preheated char was enhanced by a factor of 3.6 to 9.1 times, with a more developed pore structure and less graphitization, thus enhancing the surface reactivity of the preheated char. The increase in λPr also facilitated the conversion from pyrrolic nitrogen to pyridinic nitrogen, thus improving combustion performance and facilitating subsequent nitrogen removal. These findings provide essential data support for advancing the understanding of preheating characteristics in high-alkali coal and for promoting the development of efficient and clean combustion technologies tailored for high-alkali coal. Full article
(This article belongs to the Special Issue Optimization of Efficient Clean Combustion Technology: 2nd Edition)
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15 pages, 1483 KB  
Article
Thermodynamic and Experimental Investigation of Lead Removal from Pb-Sb Alloy Using an H3PO4-(NaPO3)6 Composite Agent
by Jiahui Tan, Xiangfeng Kong, Jia Yang, Dachun Liu and Hongwei Yang
Metals 2026, 16(2), 135; https://doi.org/10.3390/met16020135 - 23 Jan 2026
Viewed by 106
Abstract
This study presents a rapid and efficient laboratory-scale process for removing lead from Pb–Sb alloy melts using a composite H3PO4–(NaPO3)6 flux. Thermodynamic analysis was combined with experimental investigation to elucidate the influence of key parameters on [...] Read more.
This study presents a rapid and efficient laboratory-scale process for removing lead from Pb–Sb alloy melts using a composite H3PO4–(NaPO3)6 flux. Thermodynamic analysis was combined with experimental investigation to elucidate the influence of key parameters on lead removal behavior. The Wilson equation was employed to describe the non-ideal behavior of the Pb–Sb system, enabling estimation of equilibrium lead contents and providing theoretical support for interpreting experimental trends. Under the investigated conditions (1073 K, H3PO4/(NaPO3)6 mass ratio of 2:1, and a holding time of 10 min), the Pb mass fraction was reduced from 10.0 wt.% to 0.018 wt.%, corresponding to a lead removal efficiency of 99.86%. Compared with the traditional refining processes, this method shortens the processing time and avoids the use of volatile gas reagents, demonstrating its potential for lead–antimony separation. The results provide thermodynamic and experimental insight into phosphate-based refining of crude antimony. Full article
(This article belongs to the Section Extractive Metallurgy)
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24 pages, 3449 KB  
Article
Sustainable Hazardous Mitigation and Resource Recovery from Oil-Based Drill Cuttings Through Slow Pyrolysis: A Kinetic and Product Analysis
by Andres Reyes-Urrutia, Anabel Fernandez, Rodrigo Torres-Sciancalepore, Daniela Zalazar-García, César Venier, César Rozas-Formandoy, Gastón Fouga, Rosa Rodriguez and Germán Mazza
Sustainability 2026, 18(2), 969; https://doi.org/10.3390/su18020969 - 17 Jan 2026
Viewed by 189
Abstract
The expansion of unconventional hydrocarbon extraction in the Vaca Muerta Formation (Argentina) has increased the generation of oil-based drill cuttings (OBDCs), a hazardous waste containing up to 20 wt% total petroleum hydrocarbons (TPHs) and trace metals. These characteristics pose risks to soil and [...] Read more.
The expansion of unconventional hydrocarbon extraction in the Vaca Muerta Formation (Argentina) has increased the generation of oil-based drill cuttings (OBDCs), a hazardous waste containing up to 20 wt% total petroleum hydrocarbons (TPHs) and trace metals. These characteristics pose risks to soil and groundwater, highlighting the need for sustainable treatment technologies that minimize environmental impacts and enable resource recovery. This study evaluates slow pyrolysis as a thermochemical route for OBDC stabilization and valorization. Representative samples were characterized through proximate, ultimate, and metal analyses, confirming a complex hydrocarbon–mineral matrix with 78.1 wt% ash, 15.9 wt% volatile matter, and 12.5 wt% TPH. Thermogravimetric analysis (10–20 °C min−1), combined with isoconversional methods, identified three pseudo-components with activation energies ranging from 41.9 to 104.5 kJ mol−1. Slow pyrolysis experiments in a fixed bed (400–650 °C) reduced residual TPH to below 1 wt% at temperatures ≥ 400 °C, meeting Argentine criteria for non-hazardous solids. The process also produced a condensed liquid organic fraction, supporting its potential within circular-economy strategies. Overall, the results show that slow pyrolysis is a viable and sustainable technology for reducing environmental risks from OBDC while enabling resource and energy recovery, contributing to a broader understanding of their thermochemical treatment. Full article
(This article belongs to the Section Energy Sustainability)
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29 pages, 2565 KB  
Article
Characterization of Low-Alcohol Wines Obtained by Post-Fermentative Reverse Osmosis and Vacuum Concentration
by Răzvan Vasile Filimon, Florin Dumitru Bora, Constantin Bogdan Nechita, Marius Niculaua, Cătălin Ioan Zamfir, Roxana Mihaela Filimon, Ancuţa Nechita and Valeriu V. Cotea
Foods 2026, 15(2), 321; https://doi.org/10.3390/foods15020321 - 15 Jan 2026
Viewed by 322
Abstract
In the context of climate change and the general trend toward a healthy lifestyle, reducing the alcoholic strength of wines poses a major challenge for producers. In order to obtain quality low-alcohol wines (LAWs), Muscat Ottonel conventional wine was subjected to reverse osmosis [...] Read more.
In the context of climate change and the general trend toward a healthy lifestyle, reducing the alcoholic strength of wines poses a major challenge for producers. In order to obtain quality low-alcohol wines (LAWs), Muscat Ottonel conventional wine was subjected to reverse osmosis followed by vacuum concentration of the hydroalcoholic permeate (ROVC) or to two-step vacuum concentration (TSVC), with the recovery of aromas as the first alcoholic fraction (F1). Beverages with alcoholic concentrations of 3.50, 5.50, and 8.50% vol. were obtained, with compositional characteristics and sensory properties varying significantly with alcoholic strength and dealcoholization technique applied. ROVC produced wines with organic acids, volatile constituents, extract, and color intensity decreasing progressively with the reduction in alcohol concentration. At similar alcohol concentration, TSVC LAW showed a significantly higher phenolic content, antioxidant activity, volatile compounds (including esters and terpenes), and overall structural balance, maintaining better the typicity of wines. In both processes, reducing alcohol below 5.50% vol. significantly affected the quality and acceptability of the final product. Hierarchical cluster analysis indicated that TSVC LAWs were statistically closer to the conventional wine (control). These findings improve the understanding of how dealcoholization technologies affect the composition of wine, improving product quality, sustainability, and operational efficiency. Full article
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17 pages, 1692 KB  
Article
Non-Targeted Analysis of Carbofuran and Related Compounds in Commercial Formulations and Animal Tissue
by Genny Grasselli, Adriana Arigò, Giorgio Famiglini, Zdena Skrob, Arthur Sniegon, Tomas Cajthaml and Achille Cappiello
Molecules 2026, 31(2), 259; https://doi.org/10.3390/molecules31020259 - 12 Jan 2026
Viewed by 173
Abstract
Recently, some cases of intentional animal poisoning using Carbofuran (CF) occurred in the Czech Republic, although CF is no longer available in the EU market. The present study describes a novel non-targeted analysis (NTA) workflow developed to possibly characterize 13 CF formulations from [...] Read more.
Recently, some cases of intentional animal poisoning using Carbofuran (CF) occurred in the Czech Republic, although CF is no longer available in the EU market. The present study describes a novel non-targeted analysis (NTA) workflow developed to possibly characterize 13 CF formulations from various sources to be certainly identified in real samples. Furthermore, a detection and quantification method for CF was developed for analyzing three animal samples, obtained from dead animals. The analyses were conducted using the liquid electron ionization (LEI) interface coupled with a quadrupole time-of-flight (QTOF) mass spectrometer, allowing the simultaneous characterization of the formulation’s volatile and low-volatile fractions. Almost all compounds detected in the different formulations were identified by comparing the experimental spectra with the NIST library at high probability values (95–99.38%). Determination of molecular ions, followed by MS/MS analysis, was performed to confirm compound identities at a high level of confidence. The quantification method for CF was successfully validated, showing negligible matrix effects (107%). CF was detected in two out of the three real samples. Only 3-keto-carbofuran was detected in one of the real samples; without any other marker, it was not possible to identify the specific formulation used in the three poisoning cases. Full article
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23 pages, 3764 KB  
Article
Selective Permeability of Volatile Organic Compounds in Candelilla Wax Edible Films
by Samuel Macario Padilla-Jiménez, Jose Manuel Oregel-Zamudio, Sergio Arias-Martínez, Jesús Rubén Torres-García and Ernesto Oregel-Zamudio
Foods 2026, 15(2), 233; https://doi.org/10.3390/foods15020233 - 9 Jan 2026
Viewed by 298
Abstract
This study screens the permeability of volatile organic compounds (VOCs) through edible films made of candelilla wax and guar gum, offering new insights into their role as aroma and moisture barriers. Four formulations (0.2–0.4% wax, 0.4–0.8% gum, and 0.2–0.3% glycerol) were tested using [...] Read more.
This study screens the permeability of volatile organic compounds (VOCs) through edible films made of candelilla wax and guar gum, offering new insights into their role as aroma and moisture barriers. Four formulations (0.2–0.4% wax, 0.4–0.8% gum, and 0.2–0.3% glycerol) were tested using a fractional factorial design. VOC fluxes (one ester, two aldehydes, two terpenes, and one lactone) were monitored via headspace solid-phase microextraction coupled to gas chromatography–mass spectrometry (HS-SPME/GC-MS) in a diffusion cell and modeled kinetically. Wax-rich matrices compacted the network, reducing initial VOC transmission by up to 60%, while glycerol fine-tuned micromobility and selectivity. The formulation containing 0.4% wax, 0.8% gum, and 0.2% glycerol minimized time-dependent flux acceleration and reduced the cumulative permeability of both polar (hexanal) and non-polar (limonene) markers by 80%. Aroma loss decreased across all blends, correlating with improved water vapor control. These results establish quantitative criteria for developing sustainable edible coatings that balance aroma retention, water-barrier performance, and mechanical flexibility. Full article
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23 pages, 9605 KB  
Article
Divergent Impacts of Climate Change and Human Activities on Vegetation Dynamics Across Land Use Types in Hunan Province, China
by Qing Peng, Cheng Li, Xiaohong Fang, Zijie Wu, Kwok Pan Chun and Thanti Octavianti
Sustainability 2026, 18(2), 621; https://doi.org/10.3390/su18020621 - 7 Jan 2026
Viewed by 245
Abstract
Terrestrial ecosystems in Hunan Province have undergone marked yet spatially heterogeneous vegetation changes under concurrent climate change and intensifying human activities. The aim of this study is to resolve how vegetation responses vary among land-use types by quantifying kernel Normalized Difference Vegetation Index [...] Read more.
Terrestrial ecosystems in Hunan Province have undergone marked yet spatially heterogeneous vegetation changes under concurrent climate change and intensifying human activities. The aim of this study is to resolve how vegetation responses vary among land-use types by quantifying kernel Normalized Difference Vegetation Index (kNDVI) dynamics during 2000–2023 using precipitation, temperature, and solar radiation, coupled with trend analysis and a partial-derivative-based attribution. Mean kNDVI increased overall at 0.0016 yr−1; vegetation improved over 76.30% of the area, whereas 5.72% of the area experienced degradation. Built-up land exhibited the largest degraded fraction (35.04%). Human activities and temperature emerged as the dominant drivers of kNDVI change, contributing 62.25% and 27.92%, respectively, while precipitation (3.08%) and solar radiation (6.77%) played comparatively minor roles. Spatially, human activities primarily controlled vegetation dynamics in plains and urban clusters (~78% of the area), whereas temperature constrained vegetation in high-elevation mountain ranges. Analysis along the human footprint (HFP) gradient reveals that driver composition remains steady in resilient ecosystems (farmland and forest), despite increasing anthropogenic pressure, whereas fragile ecosystems (grassland and bareland) exhibited pronounced volatility and heightened sensitivity to environmental constraints. These findings provide a quantitative basis for developing sustainable ecological security strategies, incorporating region-specific measures such as adaptive afforestation, sustainable agricultural management, and strict ecological protection, to enhance ecosystem resilience by prioritizing the climate resilience of mountain forests and the stability of fragile grassland systems. Full article
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26 pages, 378 KB  
Review
Airborne Radioiodine: A Comparative View of Chemical Forms in Medicine, Nuclear Industry, and Fallout Scenarios
by Klaus Schomäcker, Ferdinand Sudbrock, Thomas Fischer, Felix Dietlein, Markus Dietlein, Philipp Krapf and Alexander Drzezga
Int. J. Mol. Sci. 2026, 27(2), 590; https://doi.org/10.3390/ijms27020590 - 6 Jan 2026
Viewed by 437
Abstract
Airborne iodine-131 plays a pivotal role in both nuclear medicine and nuclear safety due to its radiotoxicity, volatility, and affinity for the thyroid gland. Although the total exhaled activity after medical I-131 therapy is minimal, over 95% of this activity appears in volatile [...] Read more.
Airborne iodine-131 plays a pivotal role in both nuclear medicine and nuclear safety due to its radiotoxicity, volatility, and affinity for the thyroid gland. Although the total exhaled activity after medical I-131 therapy is minimal, over 95% of this activity appears in volatile organic forms, which evade standard filtration and reflect metabolic pathways of iodine turnover. Our experimental work in patients and mice confirms the metabolic origin of these species, modulated by thyroidal function. In nuclear reactor environments, both under routine operation and during accidents, organic iodides such as [131I]CH3I have also been identified as major airborne components, often termed “penetrating iodine” due to their low adsorption to conventional filters. This review compares the molecular speciation, environmental persistence, and dosimetric impact of airborne I-131 across clinical, technical, and accidental release scenarios. While routine reactor emissions yield negligible doses (<0.1 µSv/year), severe nuclear incidents like Chernobyl and Fukushima have resulted in significant thyroid exposures. Doses from these events ranged from tens of millisieverts to several Sieverts, particularly in children. We argue that a deeper understanding of chemical forms is essential for effective risk assessment, filtration technology, and emergency preparedness. Iodine-131 exemplifies the dual nature of radioactive substances: in nuclear medicine its radiotoxicity is therapeutically harnessed, whereas in industrial or reactor contexts it represents an unwanted hazard. The same physicochemical properties that enable therapeutic efficacy also determine, in the event of uncontrolled release, the range, persistence, and the potential for unwanted radiotoxic exposure in the general population. In nuclear medicine, exhaled activity after radioiodine therapy is minute but largely organically bound, reflecting enzymatic and metabolic methylation processes. During normal reactor operation, airborne iodine levels are negligible and dominated by inorganic vapors efficiently captured by filtration systems. In contrast, major accidents released large fractions of volatile iodine, primarily as elemental [131I]I2 and organically bound iodine species like [131I]CH3I. The chemical nature of these compounds defined their atmospheric lifetime, transport distance, and deposition pattern, thereby governing the thyroid dose to exposed populations. Chemical speciation is the key determinant across all scenarios. Exhaled iodine in medicine is predominantly organic; routine reactor releases are negligible; severe accidents predominantly release elemental and organic iodine that drive environmental transport and exposure. Integrating these domains shows how chemical speciation governs volatility, mobility, and bioavailability. The novelty of this review lies not in introducing new iodine chemistry, but in the systematic comparative synthesis of airborne radioiodine speciation across medical therapy, routine nuclear operation, and severe accident scenarios, identifying chemical form as the unifying determinant of volatility, environmental transport, and dose. Full article
(This article belongs to the Topic Environmental Toxicology and Human Health—2nd Edition)
19 pages, 1817 KB  
Article
Volatiles Generated in the Pyrolysis of Greenhouse Vegetable Waste
by Sergio Medina, Ullrich Stahl, Fernando Gómez, Angela N. García and Antonio Marcilla
Biomass 2026, 6(1), 2; https://doi.org/10.3390/biomass6010002 - 4 Jan 2026
Viewed by 280
Abstract
Waste valorization is a necessary activity for the development of the circular economy. Pyrolysis as a waste valorization pathway has been extensively studied, as it allows for obtaining different fractions with diverse and valuable applications. The joint analysis of results generated by thermogravimetry [...] Read more.
Waste valorization is a necessary activity for the development of the circular economy. Pyrolysis as a waste valorization pathway has been extensively studied, as it allows for obtaining different fractions with diverse and valuable applications. The joint analysis of results generated by thermogravimetry (TGA) and analytical pyrolysis (Py-GC/MS) allows for the characterization of waste materials and the assessment of their potential as sources of energy, value-added chemicals and biochar, as well as providing awareness for avoiding potential harmful emissions if the process is performed without proper control or management. In the present study, these techniques were employed on three greenhouse plant residues (broccoli, tomato, and zucchini). Analytical pyrolysis was conducted at eight temperatures ranging from 100 to 800 °C, investigating the evolution of compounds grouped by their functional groups, as well as the predominant compounds of each biomass. It was concluded that the decomposition of biomass initiates between 300–400 °C, with the highest generation of volatiles occurring around 500–600 °C, where pyrolytic compounds span a wide range of molecular weights. The production of organic acids, ketones, alcohols, and furan derivatives peaks around 500 °C, whereas alkanes, alkenes, benzene derivatives, phenols, pyrroles, pyridines, and other nitrogenous compounds increase with temperature up to 700–800 °C. The broccoli biomass exhibited a higher yield of alcohols and furan derivatives, while zucchini and tomato plants, compared to broccoli, were notable for their nitrogen-containing groups (pyridines, pyrroles, and other nitrogenous compounds). Full article
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18 pages, 14655 KB  
Article
Wearable Sensors to Estimate Outdoor Air Quality of the City of Turin (NW Italy) in an IoT Context: A GIS-Mapped Representation of Diffused Data Recorded over One Year of Monitoring
by Jessica Maria Chicco, Enrico Prenesti, Valerio Morando, Francesco Fiermonte and Giuseppe Mandrone
Smart Cities 2026, 9(1), 7; https://doi.org/10.3390/smartcities9010007 - 30 Dec 2025
Viewed by 407
Abstract
Air pollution is a growing environmental issue in densely populated urban areas worldwide. Rapid population growth and the consequent increase in energy demand, emissions from industrial activities and vehicular traffic, and the reduction in vegetation cover have in recent years led to increasing [...] Read more.
Air pollution is a growing environmental issue in densely populated urban areas worldwide. Rapid population growth and the consequent increase in energy demand, emissions from industrial activities and vehicular traffic, and the reduction in vegetation cover have in recent years led to increasing concerns about quality of life, especially due to serious health problems associated with respiratory diseases. This study focuses on air quality in the city of Turin in north-western Italy. Continuous one-year monitoring, which collected approximately two million georeferenced data points, was possible using specific devices—palm-sized, wearable, and commercially available sensors—in different parts of the city. This enabled the assessment of the geographical and seasonal distributions of the most commonly studied air pollutants, namely particulate matter (PM) of three size fractions, nitrogen dioxide (NO2), and total volatile organic compounds (TVOCs). The results highlight that the north-western zone and the urban centre are the most polluted areas. In particular, seasonal variations suggest that space heating and cooling systems, together with industrial activities, are the main contributors, more so than vehicular traffic. In this context, handheld devices in an IoT context can provide a reliable description of the spatial and temporal distribution of common air pollutants. Full article
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11 pages, 1957 KB  
Article
Quantifying the Impact of High Emitters on Vehicle Emissions: An Analysis of Ecuador’s Inspection and Maintenance Program
by Sergio Ibarra-Espinosa, Zamir Mera, Karl Ropkins and Jose Antonio Mantovani Junior
Atmosphere 2026, 17(1), 31; https://doi.org/10.3390/atmos17010031 - 25 Dec 2025
Viewed by 539
Abstract
On-road vehicles are a primary source of urban air pollution. It is known that high-emitting vehicles represent a fraction of the fleet but contribute significantly to the total emissions. Usually, road transportation emission inventories do not capture the impact of these types of [...] Read more.
On-road vehicles are a primary source of urban air pollution. It is known that high-emitting vehicles represent a fraction of the fleet but contribute significantly to the total emissions. Usually, road transportation emission inventories do not capture the impact of these types of vehicles, underestimating emissions. This study introduces a simple method to refine vehicle emission inventories by incorporating data from Ecuador’s Inspection and Maintenance (I/M) program. We analyzed I/M data from Quito to develop a correction factor for the Vehicular Emissions INventory (VEIN) model, accounting for the higher emissions from vehicles that fail inspection. Our analysis shows that while less than 10% of gasoline and 20% of diesel vehicles failed inspection, their emissions were substantially higher; for instance, accounting for reproved vehicles produced 60% more Carbon Monoxide (CO), 18% more Non-Methanic Volatile Organic Compounds (NMVOC), 40% more Particulate Matter with aerodynamical diameter of 2.5 µm or less (PM2.5), and 34% more or lower than 10 µm (PM10). These findings demonstrate that incorporating I/M data is crucial for accurately quantifying vehicular pollution. The proposed methodology offers a way to create more accurate emission estimates, providing a tool for policymakers to manage air quality. Full article
(This article belongs to the Special Issue Impacts of Anthropogenic Emissions on Air Quality)
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15 pages, 1130 KB  
Article
Determination of Energy Interaction Parameters for the UNIFAC Model Based on Solvent Activity Coefficients in Benzene–D2EHPA and Toluene–D2EHPA Systems
by Vladimir Glebovich Povarov, Olga Vladimirovna Cheremisina and Daria Artemovna Alferova
Chemistry 2026, 8(1), 2; https://doi.org/10.3390/chemistry8010002 - 23 Dec 2025
Viewed by 454
Abstract
This study examines the activity coefficients of benzene, toluene, and di-(2-ethylhexyl)phosphoric acid (D2EHPA) in binary benzene–D2EHPA and toluene–D2EHPA systems, as well as the ternary n-hexane–toluene–D2EHPA system, using gas chromatography at 293.0 K. The primary objective was to determine UNIFAC model interaction parameters and [...] Read more.
This study examines the activity coefficients of benzene, toluene, and di-(2-ethylhexyl)phosphoric acid (D2EHPA) in binary benzene–D2EHPA and toluene–D2EHPA systems, as well as the ternary n-hexane–toluene–D2EHPA system, using gas chromatography at 293.0 K. The primary objective was to determine UNIFAC model interaction parameters and validate their accuracy for predicting thermodynamic behavior in these systems. Experimental measurements revealed activity coefficient maxima for benzene and toluene at mole fractions of 0.8–0.9, decreasing to 0.46–0.67 in dilute solutions. The UNIFAC interaction parameters were calculated as follows: ACH–HPO4 (−334, 4605), ACCH3–HPO4 (680, 467), and refined CH2–HPO4 (54, 1199). The UNIFAC model achieved deviations of less than 2% from experimental data in both binary and ternary systems. A novel methodology incorporating intermediate standards for gas chromatography was developed to overcome challenges in measuring volatile solvent concentrations, enhancing measurement precision. These findings enable accurate prediction of activity coefficients in mixtures of alkanes, cycloalkanes, and monoaromatic hydrocarbons with D2EHPA, offering significant implications for optimizing metal liquid–liquid extraction processes. Full article
(This article belongs to the Section Physical Chemistry and Chemical Physics)
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28 pages, 4613 KB  
Article
Mineralogy and Geochronology of Columbite–Tantalite Group Minerals from the Huangliangou Pegmatite in Western Yunnan, China: Implications for Formations and Ore Genesis
by Qianru Gao, Yuancan Ying, Haijun Yu, Fuchuan Chen and Wenchang Li
Minerals 2026, 16(1), 16; https://doi.org/10.3390/min16010016 - 23 Dec 2025
Viewed by 327
Abstract
The Huangliangou Nb-Ta-Be deposit in the Baoshan Block of western Yunnan hosts two distinct generations of columbite–tantalite group minerals (CGMs) and tapiolite, which record the evolution of a highly fractionated rare metal pegmatite. To investigate the relationship between Huangliangou pegmatite differentiation and Nb-Ta [...] Read more.
The Huangliangou Nb-Ta-Be deposit in the Baoshan Block of western Yunnan hosts two distinct generations of columbite–tantalite group minerals (CGMs) and tapiolite, which record the evolution of a highly fractionated rare metal pegmatite. To investigate the relationship between Huangliangou pegmatite differentiation and Nb-Ta mineralization, we conducted an integrated study combining petrography with mineral chemistry and geochronology. Electron probe microanalysis (EPMA) was used to determine the compositions of two CGMs and tapiolite. LA-ICP-MS U-Pb dating of these Nb-Ta oxides yields weighted mean ages of 60.25 ± 0.75 Ma for CGM-1 and 59.4 ± 1.1 Ma for CGM-2, indicating their synchronous formation in the early Paleocene. LA-ICP-MS trace element analysis of muscovite reveals a trend of decreasing Nb/Ta and K/Rb ratios with increasing Cs content from two-mica to garnet-bearing pegmatites. This chemical evolution in muscovite parallels the mineralogical transition from magmatic CGM-1 to metasomatic CGM-2 and tapiolite, confirming that late-stage hydrothermal fluids were characterized by volatile enrichment and Ta accumulation. The textural and chemical evolution reflects a late-stage, fluid-assisted autometasomatism within a highly fractionated melt. These results identify the northern garnet-bearing pegmatite dikes as a high-priority target for Ta exploration and provide a chrono-lithological framework for prospecting Paleocene pegmatite-type Nb-Ta deposits in western Yunnan and comparable Tethyan settings. Full article
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17 pages, 3103 KB  
Article
Multi-Analytical Insight into the Non-Volatile Phytochemical Composition of Coleus aromaticus (Roxb.) Benth.
by Chiara Toniolo, Martina Bortolami, Adriano Patriarca, Daniela De Vita, Fabio Sciubba and Luca Santi
Metabolites 2026, 16(1), 15; https://doi.org/10.3390/metabo16010015 - 23 Dec 2025
Viewed by 273
Abstract
Background/Objectives: Coleus aromaticus (Lamiaceae), also known as Cuban oregano or Indian borage, is a semi-succulent perennial species widely used in traditional medicine for its therapeutic and nutritional properties. While its essential oils and aromatic fraction have been extensively investigated, the characterization of [...] Read more.
Background/Objectives: Coleus aromaticus (Lamiaceae), also known as Cuban oregano or Indian borage, is a semi-succulent perennial species widely used in traditional medicine for its therapeutic and nutritional properties. While its essential oils and aromatic fraction have been extensively investigated, the characterization of its non-volatile metabolites remains limited. The aim of this study was to explore the chemical composition of fresh leaves with a focus on the non-volatile fraction. Methods: Fresh leaves of C. aromaticus were cryogenically treated with liquid nitrogen, ground, and subjected to three different extraction procedures: hydroalcoholic maceration, ethyl acetate maceration, and liquid–liquid partitioning to obtain a dichloromethane organic phase and a hydroalcoholic phase. Extracts and fractions were analyzed by HPTLC and HPLC for metabolic profiling. In addition, the Bligh–Dyer method was applied to separate polar and non-polar metabolites, which were subsequently characterized using NMR spectroscopy. Results: Chromatographic analyses highlighted the occurrence and distribution of organic acids, polyphenols (notably flavonoids), and proteinogenic amino acids. Spectroscopic data confirmed the presence of diverse polar and non-polar metabolites, providing a more detailed chemical fingerprint of C. aromaticus. This integrated approach broadened the phytochemical profile of the species beyond the well-documented essential oils. Conclusions: The results contribute to a better understanding of the non-volatile metabolites of C. aromaticus, offering novel insights into its chemical diversity. These findings highlight the potential of this plant as a valuable source of bioactive compounds, supporting its future application in nutraceutical and pharmaceutical research. Full article
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42 pages, 967 KB  
Article
A Stochastic Fractional Fuzzy Tensor Framework for Robust Group Decision-Making in Smart City Renewable Energy Planning
by Muhammad Bilal, A. K. Alzahrani and A. K. Aljahdali
Fractal Fract. 2026, 10(1), 6; https://doi.org/10.3390/fractalfract10010006 - 22 Dec 2025
Viewed by 384
Abstract
Modern smart cities face increasing pressure to invest in sustainable and reliable energy systems while navigating uncertainties arising from fluctuating market conditions, evolving technology landscapes, and diverse expert opinions. Traditional multi-criteria decision-making (MCDM) approaches often fail to fully represent these uncertainties [...] Read more.
Modern smart cities face increasing pressure to invest in sustainable and reliable energy systems while navigating uncertainties arising from fluctuating market conditions, evolving technology landscapes, and diverse expert opinions. Traditional multi-criteria decision-making (MCDM) approaches often fail to fully represent these uncertainties as they typically rely on crisp inputs, lack temporal memory, and do not explicitly account for stochastic variability. To address these limitations, this study introduces a novel Stochastic Fractional Fuzzy Tensor (SFFT)-based Group Decision-Making framework. The proposed approach integrates three dimensions of uncertainty within a unified mathematical structure: fuzzy representation of subjective expert assessments, fractional temporal operators (Caputo derivative, α=0.85) to model the influence of historical evaluations, and stochastic diffusion terms (σ=0.05) to capture real-world volatility. A complete decision algorithm is developed and applied to a realistic smart city renewable energy selection problem involving six alternatives and six criteria evaluated by three experts. The SFFT-based evaluation identified Geothermal Energy as the optimal choice with a score of 0.798, followed by Offshore Wind (0.722) and Waste-to-Hydrogen (0.713). Comparative evaluation against benchmark MCDM methods—TOPSIS (Technique for Order Preference by Similarity to Ideal Solution), VIKOR (VIšekriterijumsko KOmpromisno Rangiranje), and WSM (Weighted Sum Model)—demonstrates that the SFFT approach yields more robust and stable rankings, particularly under uncertainty and model perturbations. Extensive sensitivity analysis confirms high resilience of the top-ranked alternative, with Geothermal retaining the first position in 82.4% of 5000 Monte Carlo simulations under simultaneous variations in weights, memory parameter (α[0.25,0.95]), and noise intensity (σ[0.01,0.10]). This research provides a realistic, mathematically grounded, and decision-maker-friendly tool for strategic planning in uncertain, dynamic urban environments, with strong potential for deployment in wider engineering, management, and policy applications. Full article
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