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Keywords = diffuse reflectance indices

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20 pages, 5328 KB  
Article
Cerium-Based Metal–Organic Frameworks (MOFs) for Catalytic Hydroxylation of Organic Molecules
by Muath Alharbi, Mostafa E. Salem and Hani Nasser Abdelhamid
Catalysts 2026, 16(3), 271; https://doi.org/10.3390/catal16030271 - 17 Mar 2026
Abstract
Three cerium-based metal–organic frameworks (MOFs), Ce-BDC, Ce-BDC-NH2, and Ce-BTC, were used as catalysts for the hydroxylation of several organic compounds, including those not relevant to environmental or biological systems. Structural characteristics were validated by FT-IR spectroscopy, while SEM imaging demonstrated rod-like [...] Read more.
Three cerium-based metal–organic frameworks (MOFs), Ce-BDC, Ce-BDC-NH2, and Ce-BTC, were used as catalysts for the hydroxylation of several organic compounds, including those not relevant to environmental or biological systems. Structural characteristics were validated by FT-IR spectroscopy, while SEM imaging demonstrated rod-like morphologies of 100–200 nm in width for Ce-BDC-NH2 and 50–100 nm for Ce-BTC. The optical properties, ascertained using diffuse reflectance spectra and Tauc analysis, revealed bandgaps of 3.0 eV, 2.9 eV, and 3.6 eV for Ce-BDC, Ce-BDC-NH2, and Ce-BTC, respectively. Catalytic investigations revealed that Ce-MOFs effectively convert phenol into 1,4-dihydroxybenzene with an efficiency of 86–99%, as confirmed by UV–Vis spectroscopy and HPLC analysis using an authentic hydroquinone (1,4-dihydroxybenzene) standard. The Ce-MOFs efficiently oxidize the dyes methylene blue (MB) and Congo red (CR) and also promote the hydroxylation of L-tyrosine, indicating their relevance to biologically significant substrates. The high catalytic performance of Ce-MOF highlights the potential of Ce-based materials for environmental remediation, chemical transformation, and sustainable wastewater treatment. Full article
(This article belongs to the Section Catalytic Materials)
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21 pages, 3597 KB  
Article
Responses of Microbial Community Structure and Carbon, Nitrogen, and Sulfur Metabolic Potential in the Chishui River to Disturbances from the Characteristic Baijiu Industry
by Lan Zhang, Song Liu, Pinhua Xia, Hui Wang, Bi Chen, Chun Qing and Xianfei Huang
Water 2026, 18(6), 688; https://doi.org/10.3390/w18060688 - 15 Mar 2026
Abstract
Microbial community structure and its carbon, nitrogen, and sulfur metabolic potentials are playing crucial roles in biogeochemical cycles within river ecosystems. However, in karst terrain regions, the impact of the distinctive baijiu industry on these ecosystems remains incompletely understood. This study integrates hydrogeochemical [...] Read more.
Microbial community structure and its carbon, nitrogen, and sulfur metabolic potentials are playing crucial roles in biogeochemical cycles within river ecosystems. However, in karst terrain regions, the impact of the distinctive baijiu industry on these ecosystems remains incompletely understood. This study integrates hydrogeochemical and metagenomic techniques to elucidate how microbial communities and their metabolic potentials respond to the baijiu industry. The results indicate that microbial community richness was higher in the downstream section than in the upstream and core zones. Microbial network modularity decreased from 0.832 upstream to 0.439 downstream, indicating reduced network stability. The migration rate decreased from upstream to downstream, suggesting that species diffusion limitation was gradually enhanced. The NST index gradually decreased from upstream to downstream, reflecting a weakening of random processes and strengthening of deterministic processes within the community. We found significant enrichment of genes associated with dissimilatory nitrate reduction, sulfur oxidation, carbon fixation, and methanogenesis in the core zone, whereas the abundance of denitrification genes decreased. Environmental factor analysis revealed that pH, DO, and elevation are the key hydrochemical parameters driving changes in microbial community structure and metabolic functions. This study reveals the potential impact mechanisms of the baijiu industry on karst river ecosystems from the perspectives of microbial community ecology and metabolic functions, providing a scientific basis for watershed ecological conservation and sustainable management. Full article
(This article belongs to the Section Ecohydrology)
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16 pages, 3831 KB  
Article
Study on the Flow Characteristics and Energy Dissipation of Side Inlet/Outlet Structures
by Hai-Yan Lv, Ming-Jiang Liu, Qiang Long, Wang-Ru Wei and Jun Deng
Water 2026, 18(6), 678; https://doi.org/10.3390/w18060678 - 13 Mar 2026
Viewed by 81
Abstract
As a critical hydraulic component of pumped storage power stations, the side inlet/outlet directly affects unit efficiency, flow stability, and system safety. This study investigates the side inlet/outlet of a pumped storage power station using three-dimensional numerical simulations, focusing on the influence of [...] Read more.
As a critical hydraulic component of pumped storage power stations, the side inlet/outlet directly affects unit efficiency, flow stability, and system safety. This study investigates the side inlet/outlet of a pumped storage power station using three-dimensional numerical simulations, focusing on the influence of the diffuser length L on hydraulic performance, and further analyzes the underlying mechanisms of energy loss based on entropy production theory. The results indicate that, with increasing diffuser length L, the flow rates in individual channels gradually deviate from the design values, leading to an aggravated imbalance in flow distribution. In contrast, the velocity non-uniformity coefficient CV at the trash rack decreases, accompanied by a pronounced attenuation of recirculation and local flow separation, resulting in a more uniform and stable flow field. Moreover, increasing L improves the streamwise velocity uniformity within each channel, while the extent and intensity of the top recirculation zone are reduced, suppressing local flow separation. Quantitative analysis shows that when L increases from 65 m to 85 m, the total turbulent dissipation entropy production rate in the diffuser section increases linearly from 2732.32 W/K to 2842.32 W/K, whereas the direct dissipation entropy production rate increases from 0.41 W/K to 0.59 W/K. This indicates that turbulent dissipation entropy production plays a dominant role in the overall energy loss. Shorter diffusers tend to induce high-intensity local dissipation, whereas longer diffusers reduce local peak dissipation but increase the overall entropy production within the diffuser, reflecting a trade-off between local optimization and global energy loss. This study reveals the sensitivity and governing effects of diffuser length on the hydraulic characteristics of side inlet/outlets, providing a reference for geometry optimization and engineering design of similar hydraulic components. Full article
(This article belongs to the Section Hydraulics and Hydrodynamics)
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45 pages, 619 KB  
Article
Major Low-Molecular-Weight Metabolites from Freshwater Aquatic Macrophytes: Ecological Aspects
by Evgeny A. Kurashov, Julia V. Krylova, Alexandra M. Chernova, Yulia V. Bataeva, Eugeny A. Belyakov, Alexander G. Lapirov, Vlada V. Anikina, Viktor A. Grebennikov and Elizaveta Ya. Yavid
Molecules 2026, 31(5), 895; https://doi.org/10.3390/molecules31050895 - 8 Mar 2026
Viewed by 182
Abstract
Freshwater macrophytes shape not only the morphological “architecture” of shallow-water ecosystems but also their chemical milieu via low-molecular-weight organic compounds (LMWOCs) that may regulate phytoplankton, periphyton, and the microbiome within the leaf/shoot diffusive boundary layer and the surrounding water column. In this study, [...] Read more.
Freshwater macrophytes shape not only the morphological “architecture” of shallow-water ecosystems but also their chemical milieu via low-molecular-weight organic compounds (LMWOCs) that may regulate phytoplankton, periphyton, and the microbiome within the leaf/shoot diffusive boundary layer and the surrounding water column. In this study, GC–MS (gas chromatography–mass spectrometry) was used to identify major LMWOCs of the low-molecular-weight metabolome (LMWM) in 11 widely distributed macrophyte species (Myriophyllum spicatum L., Sparganium emersum Rehm., Sparganium gramineum Georgi, the hybrid Sparganium × foliosum A. A. Bobrov, Volkova, Mochalova et Chemeris, Persicaria amphibia (L.) Delarbre, Potamogeton perfoliatus L., Nuphar lutea (L.) Sibth. & Sm., Potamogeton pectinatus L., Potamogeton natans L., Lobelia dortmanna L., and Ceratophyllum demersum L.). Compounds contributing more than 1% to the total LMWOCs pool were considered major, increasing the ecological realism of interpretations by focusing on metabolites more likely to reach effective concentrations in the plant microenvironment. For interspecific comparisons, the maximum recorded values of relative abundance and concentrations were used to estimate species “potential”. In total, 137 major LMWOCs were detected (four remained unidentified), and their numbers varied markedly among taxa (from 11 in N. lutea to 71 in P. perfoliatus). Similarity analyses (Jaccard, Sørensen–Czekanowski, Morisita–Horn) indicated that similarity based on compound lists and similarity based on dominance structure may diverge, reflecting differences between the “LMWOCs set” and the quantitative architecture of LMWOCs within the LMWM. Fatty acids formed the core of the major fraction in all species: they were among the top three compounds in all 11 macrophytes and ranked first or second in 10 of 11, highlighting the lipid module as a universal “structure–signaling–defense/allelopathy” hub in aquatic plants. Also, an analysis of the ecological-biochemical role of the main major LMWOCs in the studied aquatic macrophytes is presented. Overall, the data offer a comparable, ecologically oriented framework for interpreting chemical regulation of communities in macrophyte-dominated habitats and for selecting target compounds/species for subsequent bioassay and field studies. Full article
(This article belongs to the Special Issue 30th Anniversary of Molecules—Recent Advances in Chemical Biology)
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25 pages, 11677 KB  
Article
In Vitro Modeling of Mycelium Biomass Growth Kinetics of the Novel Fungicolous Species Xylaria karsticola NBIMCC 9097, with Insights into Its Antimicrobial Potential
by Galena Angelova, Zlatka Ganeva, Bogdan Goranov, Nikoleta Kaneva, Mariya Brazkova, Petya Stefanova and Denica Blazheva
J. Fungi 2026, 12(3), 177; https://doi.org/10.3390/jof12030177 - 1 Mar 2026
Viewed by 360
Abstract
Xylaria karsticola NBIMCC 9097 is a recently described and rare fungicolous species originating from Bulgaria. Understanding its growth behavior and bioactive potential is essential for evaluating its biotechnological and pharmaceutical relevance. In the presented study, we model the in vitro growth kinetics of [...] Read more.
Xylaria karsticola NBIMCC 9097 is a recently described and rare fungicolous species originating from Bulgaria. Understanding its growth behavior and bioactive potential is essential for evaluating its biotechnological and pharmaceutical relevance. In the presented study, we model the in vitro growth kinetics of X. karsticola mycelium under submerged cultivation and assess its antimicrobial activity. Optimization of MCM and MYB media markedly increased biomass yields to 20.11 and 23.25 g/dm3, respectively, compared with non-optimized media (9.9 ± 0.21 and 10.8 ± 0.28 g/dm3). The maximum specific growth rate was higher in the MCM (0.803 ± 0.004 h−1) in comparison with the MYB medium (0.711 ± 0.003 h−1); however, the MYB medium supported greater biomass accumulation and more efficient substrate utilization, reflected by a higher utilization coefficient (0.9900 ± 0.001 versus 0.9644 ± 0.005). The antimicrobial activity was evaluated using agar disk diffusion and minimum inhibitory concentration assays against Gram-positive and Gram-negative bacteria and yeasts. Hexane and ethyl acetate extracts were most effective against Pseudomonas aeruginosa ATCC 9027 (MIC 0.067 and 0.059 mg/cm3), while notable anti-yeast activity was observed, particularly against Wickerhamomyces anomalus, Saccharomycodes ludwigii, and Pichia membranifaciens. The lowest MIC (0.02 mg/cm3) was recorded for the water biomass extract against S. ludwigii indicating potent antimicrobial activity against the tested microorganism. These findings identify X. karsticola as a potential source of antimicrobial metabolites and provide a strong motivation for comprehensive metabolomic profiling and systematic optimization of its cultivation. Full article
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17 pages, 2013 KB  
Article
Efficient Encapsulation and Sustained Release of Linalyl Acetate Using Fractal Bimodal Mesoporous Silica
by Fei Liu, Andong Wang, Yuhua Bi, Ruohan Xu, Tallat Munir, Shiyang Bai, Jihong Sun, Wenliang Fu and Donggang Xu
Nanomaterials 2026, 16(5), 304; https://doi.org/10.3390/nano16050304 - 27 Feb 2026
Viewed by 453
Abstract
Linalyl acetate is a key bioactive component of essential oils with notable calming and sedative effects; however, its high volatility severely limits stability and practical application. Herein, bimodal mesoporous silica (BMMs) was employed as an efficient carrier to encapsulate linalyl acetate using liquid- [...] Read more.
Linalyl acetate is a key bioactive component of essential oils with notable calming and sedative effects; however, its high volatility severely limits stability and practical application. Herein, bimodal mesoporous silica (BMMs) was employed as an efficient carrier to encapsulate linalyl acetate using liquid- and gas-phase loading strategies, enabling high loading capacity and sustained release. Under optimized gas-phase conditions (600 mg·mL−1, 85 °C, 2 h), a maximum loading capacity of 80.13% was achieved. The X-ray diffraction (XRD) and small-angle X-ray scattering (SAXS) patterns, scanning electron microscopy (SEM) images, N2 adsorption–desorption isotherms, Fourier transform infrared (FT-IR) spectra, and thermogravimetric (TG) performances confirmed the successful confinement of linalyl acetate within the bimodal mesoporous channels. Particularly, the SAXS patterns revealed the pronounced fractal characteristics, whereas the increased mass-fractal dimension (Dm) values indicated the enhanced structural compactness, and higher surface-fractal dimension (Ds) values reflected increased surface roughness upon loading. Release experiments conducted in an open environment demonstrated an excellent sustained-release performance, with only 22.41% of linalyl acetate released from BMMs over 30 days, compared with 94.41% for the free compound. Molecular dynamics simulations further elucidated that the interactions between linalyl acetate molecules and surface silanol groups dominated the adsorption process and governed diffusion within the mesoporous channels. These findings suggested that BMMs provide a robust platform for stabilizing volatile fragrance compounds and achieving long-term controlled release. Full article
(This article belongs to the Section Biology and Medicines)
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24 pages, 13944 KB  
Article
Alkali-Activated Materials from Diverse Solid Precursors: Structural, Mechanical and Radiological Properties
by Nataša Mladenović Nikolić, Marija Ivanović, Snežana Nenadović, Jelena Potočnik, Sabina Dolenec, Dušan Bučevac, Aleksandar Kandić and Ljiljana Kljajević
Gels 2026, 12(3), 200; https://doi.org/10.3390/gels12030200 - 27 Feb 2026
Viewed by 306
Abstract
This study investigates the gel characteristics of alkali-activated materials (AAMs) synthesized using wood ash (WA), and metakaolin (MK) as solid precursors. The research explores the influence of precursor type and sodium hydroxide (NaOH) concentrations in the alkali activator solution on the resulting physicochemical, [...] Read more.
This study investigates the gel characteristics of alkali-activated materials (AAMs) synthesized using wood ash (WA), and metakaolin (MK) as solid precursors. The research explores the influence of precursor type and sodium hydroxide (NaOH) concentrations in the alkali activator solution on the resulting physicochemical, microstructural, mechanical, and radiological properties of gels. The alkaline activators were prepared by mixing sodium hydroxide solutions (6 M and 12 M) with a sodium silicate (water glass) solution at a volume ratio of 1.5. The physicochemical characteristics of raw materials and AAMs were thoroughly analyzed using X-ray fluorescence (XRF), Diffuse Reflectance Infrared Fourier Transform (DRIFT) spectroscopy, X-ray diffraction (XRD), and scanning electron microscopy (SEM) with EDS elemental mapping. FTIR analysis confirmed the formation of an amorphous gels geopolymer network. XRD revealed the presence of characteristic crystalline phases (quartz, calcite) within an amorphous matrix. Mechanical properties, such as compressive strength, depended on precursor type and alkali molarity: metakaolin (12 M) reached ~14 MPa, while wood ash showed ~4 MPa (6 M) and ~0.5 MPa (12 M) due to high CaO, low Si and Al, and unfavorable SiO2/Al2O3 (5.71) and Na2O/Al2O3 (3.19) ratios. Furthermore, this research estimates radiological doses by quantifying radionuclide content via gamma-spectrometry. Alkali activation significantly reduced radiological hazard parameters, with radium equivalent activity (Raeq) decreasing to 238.0 Bq/kg and the external hazard index (Hex) to 0.643 for A12MK, while the annual effective dose rate for A12WA was only 0.265 nSv/y-all values remaining well below the recommended safety limit of 370 Bq/kg (≤1 mSv/y). The decrease in activity concentration index (Iγ), Raeq, and Hex with increasing NaOH concentration indicates effective radionuclide immobilization within the geopolymer matrix, confirming the suitability of these alkali-activated materials for safe use in construction from a radiation protection perspective. Full article
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18 pages, 2781 KB  
Article
Non-Destructive Assessment of Rice Seed Vigor and Extraction of Characteristic Spectra Based on Near-Infrared Spectroscopy
by Qing Huang, Jinxing Wei, Jiale Cheng, Mingdong Zhu, Wei Nie, Xingping Wang, Mai Hu, Zhenyu Xu, Ruifeng Kan and Wenqing Liu
Photonics 2026, 13(3), 228; https://doi.org/10.3390/photonics13030228 - 26 Feb 2026
Viewed by 397
Abstract
Rice seed vigor is one of the critical factors determining rice yield and quality. Identifying substances related to seed vigor and rapidly assessing seed vigor by non-destructive methods are of great significance for increasing rice production. This study employed near-infrared diffuse reflectance spectroscopy [...] Read more.
Rice seed vigor is one of the critical factors determining rice yield and quality. Identifying substances related to seed vigor and rapidly assessing seed vigor by non-destructive methods are of great significance for increasing rice production. This study employed near-infrared diffuse reflectance spectroscopy (NIR-DRS) and transmission spectroscopy (NIR-TS) to evaluate the vigor of naturally aged rice seeds. The NIR-DRS failed to establish a reliable relationship between spectral data and seed vigor, proving ineffective in distinguishing seed vigor. After enhancing the spectral differences between viable and non-viable seeds, the NIR-TS successfully identified high-vigor and non-viable seeds, with a partial least squares discriminant analysis (PLS-DA) model achieving accuracy and germination rates of 84.52% and 88.57% on the test set, respectively. Furthermore, three algorithms, including interval partial least squares (iPLS), genetic algorithm (GA), and competitive adaptive reweighted sampling (CARS), were applied to extract characteristic spectral wavelengths associated with seed vigor. Among these, the CARS algorithm performed the best, identifying 38 characteristic wavelengths. Wavelength analysis indicated that rice seed vigor is primarily influenced by molecules such as starch, protein, moisture, and lipids. Using the characteristic wavelengths selected by the CARS algorithm, a PLS-DA prediction model for rice seed vigor was constructed, achieving high accuracy and germination rates of 90.47% and 95.38% on the test set, respectively. This study demonstrates that NIR-TS outperforms NIR-DRS in assessing rice seed vigor. Moreover, wavelength selection techniques can effectively identify characteristic spectral features related to seed vigor and significantly enhance the prediction accuracy of the model. Full article
(This article belongs to the Special Issue Advancements in Optical Measurement Techniques and Applications)
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16 pages, 10407 KB  
Article
Carbonation Behavior of an Aged Reinforced Concrete Building in Seoul
by Sang-Rak Sim
Buildings 2026, 16(5), 927; https://doi.org/10.3390/buildings16050927 - 26 Feb 2026
Viewed by 237
Abstract
This study assessed the carbonation-related durability of an existing reinforced concrete building in Seoul scheduled for demolition to examine the level of durability performance commonly assumed for building structures. The compressive strength of concrete core specimens was compared with the estimated compressive strength [...] Read more.
This study assessed the carbonation-related durability of an existing reinforced concrete building in Seoul scheduled for demolition to examine the level of durability performance commonly assumed for building structures. The compressive strength of concrete core specimens was compared with the estimated compressive strength derived from the rebound hammer, showing similar overall trends despite noticeable scatter, indicating that rebound testing can serve as a supplementary indicator when interpreted with caution. Carbonation depth measurements revealed that indoor locations tended to exhibit the greatest carbonation depths, likely reflecting higher CO2 concentrations associated with occupancy and daily activities, as well as indoor ventilation and moisture conditions. For exterior walls, orientation affected carbonation progress; carbonation depths were greater on the southwest-facing wall than on the northwest-facing wall, suggesting that higher solar radiation may promote drying and facilitate CO2 diffusion, thereby accelerating carbonation. When the carbonation rate coefficients were compared under similar compressive strength conditions, the southeast-facing wall exhibited a coefficient approximately 1.1 times greater than that of the northwest-facing wall. These results indicate that carbonation cannot be explained by strength alone and highlight the importance of incorporating exposure-related factors (e.g., solar radiation, drying, rainfall, and shielding) into carbonation behavior assessment. Full article
(This article belongs to the Special Issue Study on the Durability of Construction Materials and Structures)
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19 pages, 2126 KB  
Article
Assessing the Bioenergy Potential of Peanut Shell Waste: High Heating Rate Combustion Behavior and Thermodynamic Analysis
by Suleiman Mousa, Abdulrahman Almithn, Ibrahim Dubdub, Abdullah Alshehab and Mohamed Anwar Ismail
Polymers 2026, 18(5), 560; https://doi.org/10.3390/polym18050560 - 26 Feb 2026
Viewed by 253
Abstract
This study provides a comprehensive analysis of peanut shell (PnS) combustion behavior using combined physicochemical characterization and non-isothermal thermogravimetric kinetics. To evaluate its potential as a sustainable solid biofuel, PnS was characterized for its proximate and ultimate composition, with its fiber structure analyzed [...] Read more.
This study provides a comprehensive analysis of peanut shell (PnS) combustion behavior using combined physicochemical characterization and non-isothermal thermogravimetric kinetics. To evaluate its potential as a sustainable solid biofuel, PnS was characterized for its proximate and ultimate composition, with its fiber structure analyzed via Van Soest methods and functional groups identified via FTIR spectroscopy. Thermogravimetric analysis (TGA) was performed at high heating rates (20,40,60, and 80 K min1) to investigate combustion stages under oxidative conditions. The results established PnS as a high-potential energy source, revealing a significant volatile matter content (65.30 wt%) and an exceptionally high heating value (20.87 MJ kg1), which surpasses many standard agricultural residues. The proximate analysis also indicated a moisture content of 9.61% and an ash content of 6.59%. TGA profiles displayed distinct decomposition stages, with the primary devolatilization occurring between 500 and 700 K. Kinetic analysis was conducted using six model-free methods: Friedman (FR), Flynn–Wall–Ozawa (FWO), Kissinger–Akahira–Sunose (KAS), Starink (STK), Kissinger (K), and Vyazovkin (VY) and the Coats-Redfern model-fitting method. The apparent activation energy Ea was found to vary with conversion (α), reflecting the complex degradation of the lignocellulosic matrix (47.86% cellulose, 28.4% lignin). The activation energy values ranged from approximately 23 kJ mol1 (VY method at low conversion) to 187 kJ mol1 (FR method at α=0.5). Model-fitting analysis identified the three-dimensional diffusion (D3) model as the governing reaction mechanism. Thermodynamic analysis indicated positive enthalpy (ΔH:70.7181.8 kJ mol1) and Gibbs free energy (ΔG: 116.2216.7 kJ mol1), with predominately negative entropy (ΔS), confirming the endothermic and non-spontaneous nature of the reaction activation. Full article
(This article belongs to the Section Circular and Green Sustainable Polymer Science)
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13 pages, 1613 KB  
Article
Development and Evaluation of a Proton Irradiation Setup for Radiobiological Studies Using Low-Energy Protons with a Polyenergetic Spectrum (0–5.5 MeV, Mean 4.1 MeV)
by Spyridon Zonitsas, Angeliki Gkikoudi, Kalliopi Kaperoni, Sotiria Triantopoulou, Panagiotis G. Matsades, Despoina Diamantaki, Athanasia Adamopoulou, Ioannis Pantalos, Constantinos Koumenis, Michail Axiotis, Anastasios Lagoyannis, Georgia I. Terzoudi, Michael Kokkoris and Alexandros G. Georgakilas
Radiation 2026, 6(1), 7; https://doi.org/10.3390/radiation6010007 - 21 Feb 2026
Viewed by 481
Abstract
Proton therapy offers superior dose localization, yet the biological effects of low-energy protons relevant to superficial tissues remain underexplored. We report the design and validation of a proton irradiation setup developed at the Tandem Accelerator of NCSR “Demokritos” for controlled radiobiological experiments. Monte [...] Read more.
Proton therapy offers superior dose localization, yet the biological effects of low-energy protons relevant to superficial tissues remain underexplored. We report the design and validation of a proton irradiation setup developed at the Tandem Accelerator of NCSR “Demokritos” for controlled radiobiological experiments. Monte Carlo simulations using Geant4 and Monte Carlo Damage Simulation (MCDS—Monte Carlo Damage Simulation) were used to determine proton energy spectra, linear energy transfer (LET), and predicted DNA damage yields. A single layer (15–20 μm in thickness) of human keratinocytes (HaCaT) was irradiated at doses from 0.65 to 3.65 Gy, and γ-H2AX foci were quantified as markers of tracks including one or more DNA double-strand breaks. The system achieved a uniform dose rate of 0.37 Gy/min, as calculated with Geant4, with a mean proton energy of 4.1 MeV (LET ≈ 8 keV/μm). A strong correlation (R2 = 0.93) was observed between proton dose and γH2AX foci per nucleus (~10 foci/Gy), reflecting damage-inducing proton tracks rather than individual DNA double-strand breaks. At higher doses, an increased fraction of cells exhibited pan-nuclear γH2AX staining, characterized by a diffuse γH2AX signal throughout the nucleus and commonly associated with extensive or clustered DNA damage and global chromatin phosphorylation. These responses are consistent with the well-established dense ionization patterns produced by low-energy protons, as indicated by the LET spectrum and supported by MCDS-predicted clustered damage yields. While the γH2AX assay does not directly resolve simple versus complex DNA lesions, the agreement between Monte Carlo modeling and the observed cellular stress responses indicates that the irradiation platform reliably reproduces the expected biological signatures of low-energy proton exposure. Consequently, the developed system provides a robust experimental tool for systematic investigations of cellular radiosensitivity and radiotoxicity, with potential applications in skin dosimetry and radioprotection. Full article
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17 pages, 2572 KB  
Article
The Role of Clinopyroxene on the Rheology of Dry Olivine–Clinopyroxene Aggregates
by Xiaodong Zheng, Zhexuan Jiang, Jianfeng Li and Maoshuang Song
Minerals 2026, 16(2), 218; https://doi.org/10.3390/min16020218 - 20 Feb 2026
Viewed by 251
Abstract
To investigate the influence of a second-phase mineral on the rheology of mantle peridotite, we conducted high-temperature deformation experiments on dry olivine–clinopyroxene (Ol-Cpx) aggregates. Cylindrical samples were manufactured using hot-isostatic pressing techniques, with Ol as the matrix phase and [...] Read more.
To investigate the influence of a second-phase mineral on the rheology of mantle peridotite, we conducted high-temperature deformation experiments on dry olivine–clinopyroxene (Ol-Cpx) aggregates. Cylindrical samples were manufactured using hot-isostatic pressing techniques, with Ol as the matrix phase and Cpx added at volume fractions of fCpx = 0.1, 0.3, and 0.5. Deformation experiments were performed in a Paterson gas-medium apparatus at a confining pressure of ~300 MPa, temperatures ranging from 1423 to 1523 K, and strain rates of ~5 × 10−6 s−1, ~1 × 10−5 s−1, ~2 × 10−5 s−1, and ~5 × 10−5 s−1. The stress exponents (n = 3.4–4.3) for two-phase aggregates are comparable to those reported for both pure Ol and pure Cpx, indicating that dislocation creep remains the dominant deformation mechanism. Increasing Cpx content does not induce a transition of dominant mechanism but leads to a slight decrease in activation energy, consistent with predictions from two-phase rheological models and reflecting the increasing contribution of Cpx to bulk deformation. Normalized flow stresses fall between the Ol and Cpx end-members within the Taylor–Sachs bounds, indicating moderate strain partitioning between phases. Aggregates with fCpx = 0.5 show slightly reduced strength and lower effective stress exponents. This is attributed to enhanced dynamic recrystallization, which triggers grain-size reduction and thereby increases the contribution of diffusion-assisted deformation, even though dislocation creep remains the dominant mechanism. These results suggest that under dry conditions, Cpx primarily modulates the rheology of olivine-rich aggregates through microstructural evolution and strain partitioning rather than by altering the dominant deformation mechanism. Full article
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31 pages, 10445 KB  
Article
Effects of Calcium Carbide Slag Incorporation on the Multiscale Performance of Sulfoaluminate Cement Mortars
by Jianqing Tang, Liaojun Zhang, Su Lu, Jiaxin Liu, Shuo Wang, Shasha Li, Jing Li and Zhongying Li
Materials 2026, 19(4), 746; https://doi.org/10.3390/ma19040746 - 14 Feb 2026
Viewed by 351
Abstract
This study investigated the effects of calcium carbide slag (CCS) (0–12 wt%) incorporation on the workability, electrochemical properties, durability, and microstructure evolution of sulfoaluminate cement (SAC) mortar. Results showed that increasing CCS content reduced mortar fluidity and shortened setting time, indicating that CCS [...] Read more.
This study investigated the effects of calcium carbide slag (CCS) (0–12 wt%) incorporation on the workability, electrochemical properties, durability, and microstructure evolution of sulfoaluminate cement (SAC) mortar. Results showed that increasing CCS content reduced mortar fluidity and shortened setting time, indicating that CCS accelerates early hydration. A 9% CCS content was determined to be the optimal dosage; at 28 days, compared to the control group, this dosage group exhibited a 6.53% increase in compressive strength, a 22.47% decrease in drying shrinkage, and a 0.279% decrease in mass loss. These performance improvements stemmed from CCS’s ability to inhibit pore connectivity and limit moisture migration. Electrochemical analysis further revealed that the 9% CCS dosage group had the highest charge transfer resistance and resistivity (30.00% higher than the control group), reflecting a denser matrix and greater ion transport resistance. Consequently, chloride ion permeability was significantly reduced, with electrical flux and diffusion coefficient decreasing by 39.98% and 28.89%, respectively. Microstructural observations confirmed that CCS promotes the formation and densification of hydration products, effectively improving the internal pore structure. While 9% CCS can serve as an effective functional supplementary material, its long-term durability and sustainability still face practical application challenges. Future research should focus on establishing predictive models for chloride ion permeation lifetime and conducting quantitative sustainability assessments of CCS-SAC composites, particularly evaluating material cost, energy consumption, and carbon dioxide emissions. Full article
(This article belongs to the Section Construction and Building Materials)
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15 pages, 1402 KB  
Article
In Silico Optimization of a Non-Invasive Optical Sensor for Hemoconcentration Monitoring in Dengue Fever Management
by Murad Althobaiti and Gameel Saleh
Biosensors 2026, 16(2), 121; https://doi.org/10.3390/bios16020121 - 13 Feb 2026
Viewed by 447
Abstract
Severe Dengue fever can cause Dengue Hemorrhagic Fever (DHF), a life-threatening condition characterized by plasma leakage and hemoconcentration. A hematocrit (Hct) rise of ≥20% is a key indicator for medical intervention, but current monitoring is invasive and intermittent. This study aims to determine [...] Read more.
Severe Dengue fever can cause Dengue Hemorrhagic Fever (DHF), a life-threatening condition characterized by plasma leakage and hemoconcentration. A hematocrit (Hct) rise of ≥20% is a key indicator for medical intervention, but current monitoring is invasive and intermittent. This study aims to determine the optimal design parameters for a non-invasive optical sensor to continuously monitor hemoconcentration. We developed a high-fidelity Monte Carlo model of light transport in a multi-layered skin model, with the epidermis set to a 5% melanin volume fraction (Fitzpatrick type II/III). To ensure signal reliability, simulations were conducted with a high photon count (1×108 photons), yielding a stochastic (Monte Carlo) signal-to-noise ratio of approximately 36 dB. We simulated diffuse reflectance at four characteristic wavelengths (577 nm, 660 nm, 800 nm—the isosbestic point—, and 940 nm) over source-detector separations of 0.5–8.0 mm. Sensor sensitivity was quantified as the reflectance change for a +25% relative Hct rise (e.g., 42% to 52.5%), mimicking severe hemoconcentration, and its dependence on baseline dermal blood volume fraction (BVF) was investigated. Sensor sensitivity showed a non-linear dependence on BVF, showing a direct correlation with perfusion level, reaching an optimal 6.41% for a robust 5% BVF at 8.0 mm. A dedicated sweep showed that even under low-perfusion shock conditions (1% BVF), the sensor maintains a highly significant sensitivity of 5.71% (also at 8.0 mm), indicating that sensitivity remains high across a physiologically relevant perfusion range. In the analysis, at a robust 5% BVF, the 800 nm wavelength demonstrated superior reliability, with peak sensitivity at 6.41% at 8.0 mm. Visible wavelengths (577 nm and 660 nm) exhibited high theoretical sensitivity, while 940 nm was compromised by water absorption. Based on these findings, a non-invasive optical sensor for hemoconcentration is most effective operating at 800 nm, within the evaluated spectral set, with a source-detector separation of ≥6.0 mm, targeting the deep dermis while minimizing superficial interference. This design provides an optimal balance of tissue penetration, robust sensitivity to Hct changes, and reduced sensitivity to oxygenation-related variability while maintaining signal stability. This work enables the design of a device for continuous monitoring, supporting continuous monitoring of hemoconcentration trends relevant to plasma leakage progression. Full article
(This article belongs to the Section Biosensors and Healthcare)
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Article
Improving Digital Soil Organic Carbon Mapping Using Continuum-Removal Spectral Indices and Multivariate Geostatistics
by Gabriele Buttafuoco, Carmela Riefolo, Massimo Conforti and Annamaria Castrignanò
Soil Syst. 2026, 10(2), 29; https://doi.org/10.3390/soilsystems10020029 - 12 Feb 2026
Viewed by 352
Abstract
This study aimed to evaluate the effectiveness of spectral absorption-feature indices, derived from soil hyperspectral diffuse reflectance spectroscopy, as covariates within a multivariate geostatistical framework to enhance the digital mapping of soil organic carbon (SOC). The approach also incorporated exhaustively measured auxiliary variables [...] Read more.
This study aimed to evaluate the effectiveness of spectral absorption-feature indices, derived from soil hyperspectral diffuse reflectance spectroscopy, as covariates within a multivariate geostatistical framework to enhance the digital mapping of soil organic carbon (SOC). The approach also incorporated exhaustively measured auxiliary variables derived from topographic and textural attributes. The research was conducted in a 1.39-km2 forested catchment, where 135 topsoil samples (0–0.20 m depth) were collected from soils classified as Typic Xerumbrepts and Ultic Haploxeralfs. All samples were analyzed for SOC concentration, soil texture, and diffuse reflectance spectra across the VIS–NIR–SWIR region (350–2500 nm). The continuum-removal technique was applied to compute radiometric indices associated with absorption features in the visible region and at 1400, 1900, and 2200 nm. Results demonstrated that these indices effectively captured the SOC spatial variability when combined with silt fraction and topographic attributes, which, among the other covariates, actually exhibited the strongest spatial relationships with SOC. Compared to univariate ordinary kriging, the multivariate geostatistical approach yielded improved prediction accuracy in cross-validation, mostly due to the use of hyperspectral indices as auxiliary variables. Moreover, the geostatistical analysis revealed that the multivariate frame of spatial association was characterized by two distinct spatial scales. The findings of this work then support the use of hyperspectral indices as valuable covariates for digital modelling of SOC distribution even in landscapes characterized by heterogeneous topography and pedology. Full article
(This article belongs to the Special Issue Use of Modern Statistical Methods in Soil Science)
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