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Search Results (1,210)

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21 pages, 9923 KB  
Article
Research on Vortex Radar Imaging Characteristics Based on the Scattering Distribution of Three-Dimensional Wind-Driven Sea Surface Waves
by Xiaoxiao Zhang, Haodong Geng, Xiang Su, Lin Ren and Zhensen Wu
Remote Sens. 2026, 18(8), 1111; https://doi.org/10.3390/rs18081111 - 8 Apr 2026
Abstract
The resolution and accuracy of airborne/spaceborne SAR are continuously improving, making it an effective means for observing ocean dynamic processes and detecting marine targets. In contrast, utilizing its unique orbital angular momentum (OAM) mode, vortex radar does not require temporal accumulation to achieve [...] Read more.
The resolution and accuracy of airborne/spaceborne SAR are continuously improving, making it an effective means for observing ocean dynamic processes and detecting marine targets. In contrast, utilizing its unique orbital angular momentum (OAM) mode, vortex radar does not require temporal accumulation to achieve azimuthal resolution, making it particularly suitable for observing moving sea surfaces. This capability enables stable and continuous monitoring of dynamic ocean scenes. This paper proposes a vortex radar imaging method based on three-dimensional sea surface scattering characteristics: first, a three-dimensional wind-driven sea surface geometric model is established based on the Elfouhaily sea spectrum, and its scattering characteristics under different incident angles, wind speeds, and wind directions are analyzed using the semi-deterministic facet-based two-scale method; then, two-dimensional range-azimuth imaging is achieved through coordinate transformation, echo modeling, pulse compression, and fast Fourier transform (FFT) in OAM mode domain, with the correctness of the imaging algorithm verified through multiple point target imaging results. Finally, simulation results of two-dimensional sea surface vortex imaging under different incident angles are presented, and the influence of wind speed and direction on sea surface vortex imaging is analyzed. The study shows that the vortex imaging system can effectively reflect wave fluctuations and wind direction characteristics, demonstrating the feasibility and potential of vortex radar imaging in oceanographic applications. Full article
(This article belongs to the Special Issue Observations of Atmospheric and Oceanic Processes by Remote Sensing)
26 pages, 2871 KB  
Article
Instability Mechanism of Voussoir Beam and Roof-Cutting Pressure Relief in Parallel Goaf: A Case Study of Shiyangou Coal Mine
by Jie Zhang, Chu Zhang, Tao Yang, Bin Wang, Shoushi Gao, Guang Qin, Jianping Sun, Yiming Zhang, Xiaogang Zhang and Zhengyang Fan
Appl. Sci. 2026, 16(7), 3608; https://doi.org/10.3390/app16073608 - 7 Apr 2026
Abstract
During coal mining, parallel voids ahead of an advancing working face often trigger intense dynamic loading and structural instability, posing significant risks to operational safety. Using the 43,201 working face of the Shiyangou Coal Mine as a case study, this research investigates the [...] Read more.
During coal mining, parallel voids ahead of an advancing working face often trigger intense dynamic loading and structural instability, posing significant risks to operational safety. Using the 43,201 working face of the Shiyangou Coal Mine as a case study, this research investigates the mechanisms of surrounding rock instability and proposes an integrated synergistic control strategy. Based on voussoir beam theory, a mechanical model of the roof structure—incorporating the nonlinear coupling between the gangue and immediate roof—was developed to establish the critical thresholds for the rotational instability of key blocks. Analytical results indicate that the limit breaking distance for “Key Block B” in the main roof is 24.49 m, which defines the primary zone for advanced reinforcement and hazard prevention. Furthermore, applying short-arm beam theory, this study clarifies how pre-split roof cutting disrupts the transmission of advance abutment pressure, identifying 8° as the optimal cutting angle. Building on these insights, a multi-faceted control system was implemented, combining hydraulic fracturing for pressure relief, pumpable backfill pillars, and an artificial false roof (utilizing a suspended I-beam structure 1.2 m above the floor). Field monitoring confirms that this collaborative approach effectively stabilizes the surrounding rock, ensuring the safe and continuous passage of the working face through parallel void areas. Full article
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23 pages, 596 KB  
Article
Perceived Cognitive Assistance in LLM-Augmented Retail Trading: Construct Definition and Content Validation
by Dmitrii Gimmelberg and Iveta Ludviga
Int. J. Financial Stud. 2026, 14(4), 83; https://doi.org/10.3390/ijfs14040083 - 1 Apr 2026
Viewed by 313
Abstract
Large language models (LLMs) are increasingly used by retail traders to interpret information and design complex strategies, yet existing adoption constructs do not capture the decision-time experience of being cognitively scaffolded by an LLM. We define Perceived Cognitive Assistance (PCA) as the trader’s [...] Read more.
Large language models (LLMs) are increasingly used by retail traders to interpret information and design complex strategies, yet existing adoption constructs do not capture the decision-time experience of being cognitively scaffolded by an LLM. We define Perceived Cognitive Assistance (PCA) as the trader’s felt expansion of cognitive capability at the moment of a trading decision when an LLM is available, and we report initial content validation of a PCA item pool. Study 1 specified the PCA content domain using a two-tier qualitative corpus (eight interviews and 44 YouTube narratives on LLM-assisted trading, plus 24 qualitative and mixed-method studies on robo-advice and social trading). Reflexive thematic analysis yielded five facilitative assistance facets and one adjacent risk facet (over-reliance), and these were translated into a 16-item PCA pool. Study 2 used a naïve-judge sort-and-rate task with 48 retail traders to test whether items show definitional correspondence to PCA and definitional distinctiveness from similar constructs: perceived usefulness, perceived ease of use, trust in the LLM, and trading self-efficacy. The resulting nine-item set is ready for subsequent factor-analytic and predictive validation. This study advances our understanding of how large language models shape retail trading behaviour by identifying and empirically grounding Perceived Cognitive Assistance as the decision-time psychological experience through which LLMs cognitively scaffold traders, clarifying how LLM use differs from generic technology adoption, trust, or self-efficacy effects. Full article
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24 pages, 2251 KB  
Article
Yeast Culture Enhances Production Performance in Late-Lactation Dairy Cows by Reshaping Rumen Microbiota and Metabolic Pathways
by Jiahui Yu, Zhi Dou, Can Wang, Shendong Zhou, Huimin Shi, Hongzhu Zhang, Hongze Wang, Nana Ma, Xiangzhen Shen and Guangjun Chang
Vet. Sci. 2026, 13(4), 336; https://doi.org/10.3390/vetsci13040336 - 31 Mar 2026
Viewed by 255
Abstract
Yeast culture (YC), a complex functional feed additive containing fermentation metabolites, has demonstrated potential in dairy production systems. However, its mechanistic effects on rumen function and host metabolism in lactating dairy cattle warrant further investigation. This study evaluated the impacts of YC supplementation [...] Read more.
Yeast culture (YC), a complex functional feed additive containing fermentation metabolites, has demonstrated potential in dairy production systems. However, its mechanistic effects on rumen function and host metabolism in lactating dairy cattle warrant further investigation. This study evaluated the impacts of YC supplementation on production performance, systemic antioxidant status, and rumen function in late-lactation Holstein cows. Fourteen multiparous Holstein cows (body weight 655 ± 28 kg; days in milk 270.4 ± 1.6 d) were randomly allocated into two groups, a control group (CON, basal diet) and a YC-supplemented group (YC, basal diet + 50 g/d YC), in a 28-day feeding trial. YC supplementation significantly increased dry matter intake (p < 0.01), nutrient digestibility (p < 0.01 for DM, CP, EE, NDF, and ADF), and milk yield (p < 0.05) compared to CON. Systemic antioxidant capacity was enhanced, as evidenced by elevated serum superoxide dismutase activity (p < 0.01) and total antioxidant capacity (p < 0.05). Rumen fermentation was improved with higher concentrations of total volatile fatty acids (p < 0.01) and microbial protein (p < 0.01) and reduced ammonia nitrogen levels (p < 0.01). Macrogenomic analysis revealed a YC-mediated restructuring of the rumen microbiota, characterized by an increased relative abundance of Firmicutes and decreased Bacteroidota. Untargeted metabolomic profiling identified significant alterations in rumen metabolite profiles, with differential metabolites enriched in pyrimidine metabolism and vitamin digestion and absorption pathways. These results indicate that YC supplementation improves production performance in late-lactation dairy cows through multi-faceted mechanisms involving rumen microbial community modulation and metabolic pathway activation, ultimately enhancing nutrient utilization and metabolic efficiency. Full article
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21 pages, 5293 KB  
Article
Prenatal Edible Bird’s Nest Supplementation Attenuates Offspring Skin Pigmentation via Dual Inhibition of CREB and ERK Signaling to Downregulate MITF-TYR Axis
by Wenrui Zhang, Yijia Zhang, Xinyuan Wang, Yujuan Chen, Liqin Chen, Jie Gao, Yixuan Li, Dongliang Wang and Yanan Sun
Nutrients 2026, 18(7), 1083; https://doi.org/10.3390/nu18071083 - 28 Mar 2026
Viewed by 311
Abstract
Background/Objectives: Edible bird’s nest (EBN) benefits skin, but its transgenerational effects are unknown. This study investigated whether maternal EBN or its key component, sialic acid (SA), could program offspring skin pigmentation and antioxidant capacity. Methods: Pregnant Sprague-Dawley rats were supplemented with EBN or [...] Read more.
Background/Objectives: Edible bird’s nest (EBN) benefits skin, but its transgenerational effects are unknown. This study investigated whether maternal EBN or its key component, sialic acid (SA), could program offspring skin pigmentation and antioxidant capacity. Methods: Pregnant Sprague-Dawley rats were supplemented with EBN or equi-sialic acid SA. Offspring skin brightness (L*, ITA°), melanin content, and key molecular targets (e.g., MITF, TYR, TRP1/2, PMEL, RAB27A, p-CREB, p-ERK, CAT, GCS, MDA) were assessed at postnatal days 0–21. Results: Maternal EBN induced a dose-dependent skin-brightening effect in offspring. High-dose EBN increased skin L* by 10.46% and ITA° by 14.28%, while reducing total melanin by 26.77%. This was mediated by downregulation of the MITF-TYR/TRP axis and its upstream CREB/ERK signaling, suppression of melanosome transport proteins (PMEL, RAB27A), and enhancement of antioxidant defenses (increased CAT/GCS, decreased MDA). SA alone showed similar but weaker effects. Conclusions: This study demonstrates that maternal EBN intake programs offspring skin towards a lighter phenotype and enhanced antioxidant status through multi-faceted regulation of melanogenesis. The superior efficacy of whole EBN over pure SA highlights the value of the intact food matrix, suggesting EBN as a promising functional food for maternal nutrition. Full article
(This article belongs to the Section Nutrition and Metabolism)
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18 pages, 3867 KB  
Article
Effect of Pulse Electrodeposition Parameters on the Catalytic Performance of PtNi Oxygen Reduction
by Fan Bu, Qingli Shu and Qi Zhang
Catalysts 2026, 16(4), 293; https://doi.org/10.3390/catal16040293 - 27 Mar 2026
Viewed by 458
Abstract
To overcome active site blockage and poor interfacial contact in traditional syntheses, PtNi bimetallic nanoparticles were grown in situ on a microporous carbon paper via pulse electrodeposition. Firstly, the impact of deposition potential was investigated. The results indicate that the deposition potential significantly [...] Read more.
To overcome active site blockage and poor interfacial contact in traditional syntheses, PtNi bimetallic nanoparticles were grown in situ on a microporous carbon paper via pulse electrodeposition. Firstly, the impact of deposition potential was investigated. The results indicate that the deposition potential significantly modulates the surface Pt0/Pt2+ ratio; concurrently, a shift toward more negative potentials intensified nanoparticle agglomeration. The effects of the duty cycle were investigated at an optimal deposition potential of −0.95 to −0.4 V. A duty cycle of 30% yielded the optimal Pt0/Pt2+ ratio. Furthermore, TEM revealed a coexisting strain profile of bulk PtNi lattice contraction and localized expansion at peripheral Pt (111) facets. This synergistic tuning of surface valence and strain optimizes the thermodynamic balance between oxygen adsorption and intermediate desorption on Pt sites. In summary, the optimal catalyst, prepared at a deposition potential of −0.95 V and a duty cycle of 30%, showed the best reaction behavior in the oxygen reduction reaction with an initial onset potential of 0.92 V (vs. RHE). After 5000 cycles of testing, the catalyst showed a constant durability, with the onset potential degrading only marginally to 0.87 V. This work successfully demonstrates that the surface morphology and valence states of the catalyst can be effectively tailored by regulating the pulse voltage and duty cycle. Full article
(This article belongs to the Section Electrocatalysis)
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20 pages, 2114 KB  
Article
Cross-Project Software Defect Prediction Based on Domain Adaptation and Feature Fusion
by Guanhua Guo, Yinglei Song and Peng Zhang
Algorithms 2026, 19(4), 253; https://doi.org/10.3390/a19040253 - 26 Mar 2026
Viewed by 250
Abstract
With the advancement of computer science, software has become increasingly prevalent across all facets of society, making software quality issues a focal point of industry concern. The scarcity of sufficient defect data in the early stages of projects undermines prediction accuracy, driving research [...] Read more.
With the advancement of computer science, software has become increasingly prevalent across all facets of society, making software quality issues a focal point of industry concern. The scarcity of sufficient defect data in the early stages of projects undermines prediction accuracy, driving research into cross-project software defect prediction. The traditional manual measurement features face challenges due to the data distribution discrepancies between original and cross-project contexts, which hinder the prediction effectiveness. Furthermore, single features fail to comprehensively characterize software information. This paper proposes a domain adaptation and feature fusion-based cross-project software defect prediction method (DAFF-CPDP). The model employs the TCA+ algorithm for domain adaptation and utilizes an encoder layer for progressive feature fusion. Multiple Java projects were selected for evaluation. The comparisons with various baseline models demonstrated that the proposed model outperforms both the traditional machine learning-based feature models and the diverse deep learning-based single-feature or multi-feature models. Concurrently, this paper analyzes the impact of different source projects on target projects, confirming that class-balanced datasets and datasets with smaller distribution differences are more conducive to project prediction. Full article
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32 pages, 1329 KB  
Review
Deep Learning-Based Gaze Estimation: A Review
by Ahmed A. Abdelrahman, Basheer Al-Tawil and Ayoub Al-Hamadi
Robotics 2026, 15(4), 69; https://doi.org/10.3390/robotics15040069 - 25 Mar 2026
Viewed by 607
Abstract
Gaze estimation, a critical facet of understanding user intent and enhancing human–computer interaction, has seen substantial advancements with the integration of deep learning technologies. Despite the progress, the application of deep learning in gaze estimation presents unique challenges, notably in the adaptation and [...] Read more.
Gaze estimation, a critical facet of understanding user intent and enhancing human–computer interaction, has seen substantial advancements with the integration of deep learning technologies. Despite the progress, the application of deep learning in gaze estimation presents unique challenges, notably in the adaptation and optimization of these models for precise gaze tracking. This paper conducts a thorough review of recent developments in deep learning-based gaze estimation, with a particular focus on the evolution from traditional methods to sophisticated appearance-based techniques. We examine the key components of successful gaze estimation systems, including input feature processing, neural network architectures, and the importance of data preprocessing in achieving high accuracy. Our analysis extends to a comprehensive comparison of existing methods, shedding light on their effectiveness and limitations within various implementation contexts. Through this systematic review, we aim to consolidate existing knowledge in the field, identify gaps in current research, and suggest directions for future investigation. By providing a clear overview of the state-of-the-art in gaze estimation and discussing ongoing challenges and potential solutions, our work seeks to inspire further innovation and progress in developing more accurate and efficient gaze estimation systems. Full article
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16 pages, 1188 KB  
Article
Pulsed Versus Conventional Radiofrequency Stimulation in Cervical Facet-Mediated Neck Pain: A Single-Centre Retrospective Cohort Study Outcomes
by Derya Bayram and Çağatay Küçükbingöz
Healthcare 2026, 14(6), 819; https://doi.org/10.3390/healthcare14060819 - 23 Mar 2026
Viewed by 240
Abstract
Background/Objectives: Cervical facet-mediated pain is a significant underlying factor of persistent neck pain (CNP). Pulsed radiofrequency (PRF) or conventional radiofrequency (CRF) has been introduced as a treatment alternative. However, comparative clinical data remain limited. Methods: This single-center retrospective cohort study analyzed [...] Read more.
Background/Objectives: Cervical facet-mediated pain is a significant underlying factor of persistent neck pain (CNP). Pulsed radiofrequency (PRF) or conventional radiofrequency (CRF) has been introduced as a treatment alternative. However, comparative clinical data remain limited. Methods: This single-center retrospective cohort study analyzed patients with cervical facet-mediated pain who underwent PRF (n = 40) or CRF (n = 44) between January 2023 and December 2024. The success of the procedure was assessed using the Numeric Rating Scale (NRS) and the Neck Disability Index (NDI) before the procedures and at 1, 3, 6, and 12 months following the injections. Patients’ feedback was evaluated using the Global Perceived Effect (GPE) scale. Results: For both groups, a substantial decrease in the mean pain and disability severity was recorded between the initial measurement and the first, third, and sixth months of follow-up, but the outcomes were significant only in the CRF group at the 12th month. The groups did not show a substantial difference in terms of pain relief, disability improvement, medication use, or patient satisfaction at one and three months (p > 0.05), but at six and 12 months, patients treated with CRF showed significantly greater outcomes (p < 0.001). No notable difference in complication rates was found between the PRF (10%) and CRF (16%) groups (p = 0.53). Conclusions: Both pulsed and conventional radiofrequency ablation effectively reduced pain and improved function in the early-midterm follow-up. However, CRF provided more sustained relief and greater patient-reported success at 6 and 12 months, without an increase in complication rates, suggesting that CRF may offer a more durable long-term treatment option. Full article
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13 pages, 2966 KB  
Article
Size-Dependent Emission Enhancement in Deep-Ultraviolet AlGaN Microrods
by Xu Sun, Ziwen Yan, Tong Xu, Jiajun Zhu, Zili Xie, Xiangqian Xiu, Dunjun Chen, Bin Liu, Yi Shi, Rong Zhang, Youdou Zheng and Peng Chen
Nanomaterials 2026, 16(6), 355; https://doi.org/10.3390/nano16060355 - 14 Mar 2026
Viewed by 290
Abstract
High-Al-content AlGaN microrods represent an effective platform for engineering deep-ultraviolet (DUV) emission. Here, we fabricated AlGaN microrods with varying diameters (2, 3, and 4 μm) via a top-down approach involving inductively coupled plasma dry etching followed by a KOH wet chemical modification. Their [...] Read more.
High-Al-content AlGaN microrods represent an effective platform for engineering deep-ultraviolet (DUV) emission. Here, we fabricated AlGaN microrods with varying diameters (2, 3, and 4 μm) via a top-down approach involving inductively coupled plasma dry etching followed by a KOH wet chemical modification. Their crystallographic facets and size-dependent optical properties were systematically investigated using scanning electron microscopy (SEM), cathodoluminescence (CL) spectroscopy, and CL mapping. We found that the KOH treatment selectively forms a-plane-dominated sidewalls on the high-Al-content portion of the microrods, whereas the etch pit bottoms stabilize as m-plane facets. Notably, the CL spectra show that the band-edge emission intensity of the 2 μm microrods is enhanced by a factor of 3.76 compared to the 4 μm structures. CL mapping further unveils the competitive dynamics between radiative recombination within the quantum wells and non-radiative recombination at surface states. These findings pinpoint 2 μm as the optimal diameter among the investigated range for maximizing spontaneous emission from these high-Al-content AlGaN microrods. Full article
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18 pages, 3268 KB  
Article
Enhanced Hydrogen Concurrent Production via Urea Solution Electrolysis Using Mesoporous Nickel Tungstate Precipitated from a Surfactant Template
by Mohamed A. Ghanem, Weaam Al-Sulmi, Abdullah M. Al-Mayouf, Nouf H. Alotaibi and Ivan P. Parkin
Catalysts 2026, 16(3), 258; https://doi.org/10.3390/catal16030258 - 11 Mar 2026
Viewed by 491
Abstract
The manipulation of the electrocatalyst nanoarchitecture, particularly transition metal compounds, regarding size, shape, facets, and composition, significantly enhances the electrocatalytic activity in energy transformations. This study introduces a novel methodology for the precipitation of mesoporous nanoparticles of nickel tungstate (meso-NiWO4) using [...] Read more.
The manipulation of the electrocatalyst nanoarchitecture, particularly transition metal compounds, regarding size, shape, facets, and composition, significantly enhances the electrocatalytic activity in energy transformations. This study introduces a novel methodology for the precipitation of mesoporous nanoparticles of nickel tungstate (meso-NiWO4) using direct chemical deposition from a template of Brij®78 surfactant liquid crystal. Physicochemical analyses revealed the formation of amorphous meso-NiWO4 nanoparticles with dual sizes of 10 ± 3 and 120 ± 8 nm and a specific surface area of 34.2 m2/g, exceeding that of nickel tungstate deposited in the absence of surfactant (bare-NiWO4, 4.0 m2/g). The meso-NiWO4 nanoparticles exhibit improved electrocatalytic stability, reduced charge-transfer resistance (Rct = 1.11 ohm), and a current mass activity of ~365 mA/cm2 mg at 1.6 V vs. RHE during the electrolysis of urea in alkaline solution. Furthermore, by employing meso-NiWO4 in a two-electrode urea electrolyzer, a remarkable 4.8-fold increase in the cathodic hydrogen concurrent production rate was achieved (373.40 µmol/h at a bias potential of 2.0 V), compared to that of the bare-NiWO4 catalyst. The exceptional urea oxidation electroactivity and the enhanced hydrogen evolution rate arise from substantial specific surface area and mesoporous structure, facilitating effective charge transfer and mass transport through the meso-NiWO4 catalyst. Using the surfactant liquid crystal template for electrocatalyst synthesis enables a one-pot deposition of diverse nanoarchitectures and compositions with high surface area at ambient conditions for an improved electrocatalytic and hydrogen green production process. Full article
(This article belongs to the Special Issue 15th Anniversary of Catalysts: Feature Papers in Electrocatalysis)
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17 pages, 1395 KB  
Review
Recent Advances in Exploring Casein Peptide Regulation of Inflammatory Bowel Disease from an Intestinal Barrier Perspective: Correlations, Mechanisms, Challenges and Solutions
by Tingting Dong, Jiahui Ye, Jinquan Zhang, Wanxuan Song, Shuaibo Xia, Xinyan Li, Mengyao Liu, Daodong Pan, Zhen Wu and Maolin Tu
Foods 2026, 15(6), 997; https://doi.org/10.3390/foods15060997 - 11 Mar 2026
Viewed by 456
Abstract
Inflammatory bowel disease (IBD) is characterized by chronic and intermittent symptoms, exerting a profound impact on overall health. Although drug therapy and biological agents are primary treatment approaches for IBD, the side effects can affect human health. Thus, it is an urgent need [...] Read more.
Inflammatory bowel disease (IBD) is characterized by chronic and intermittent symptoms, exerting a profound impact on overall health. Although drug therapy and biological agents are primary treatment approaches for IBD, the side effects can affect human health. Thus, it is an urgent need to explore new approaches to counteract the harm caused by IBD. Owing to their natural origin and excellent biosafety, casein peptides are a promising candidate treatment for IBD. This review systematically outlines the structural basis of the intestinal barrier and elucidates the pivotal role of barrier dysfunction in IBD pathogenesis. We further elaborate on the multi-faceted therapeutic mechanisms of casein peptides in IBD, including intestinal barrier repair, immune homeostasis modulation, inflammatory response suppression, and other such pathways. Moreover, we analyze the key challenges of intestinal-barrier-targeted casein peptide therapies in current research and translational practice, and propose future perspectives for overcoming these limitations, thus providing a reference for potential new preventive and therapeutic approaches to IBD. Full article
(This article belongs to the Section Dairy)
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21 pages, 7685 KB  
Article
First Principle Studies on the Reactivity and Stability of LiPF6 Surfaces in the Presence of Fluoride and Hydrogen Fluoride
by Mpho D. S. Lekgoathi and Gugu Kubheka
Surfaces 2026, 9(1), 26; https://doi.org/10.3390/surfaces9010026 - 11 Mar 2026
Viewed by 261
Abstract
The effect of LiPF6 acidity, represented by LiPF6·xHF adduct formation and its interaction with fluoride species, on the surface reactivity and stability of LiPF6 was investigated using density functional theory (DFT) calculations performed with the Vienna Ab initio Simulation [...] Read more.
The effect of LiPF6 acidity, represented by LiPF6·xHF adduct formation and its interaction with fluoride species, on the surface reactivity and stability of LiPF6 was investigated using density functional theory (DFT) calculations performed with the Vienna Ab initio Simulation Package (VASP). The exchange–correlation energy was described using the Perdew–Burke–Ernzerhof (PBE) functional within the Generalized Gradient Approximation (GGA). Four distinct surface terminations of the (003) and (101) facets—F4–P2–Li, P2–F3–Li, Li2–F3–P, and F4–Li2–P were systematically examined. Surface and adsorption energies were evaluated together with key electronic descriptors, including the work function, dipole moment, electron localization function (ELF), electrostatic potential, band structure, and density of states, to elucidate the mechanisms governing adsorption and stability. The (101) facet exhibits a pronounced susceptibility to HF-induced solvation, driven by enhanced surface polarity, a low work function, and intermolecular H–F interactions at lithium-exposed terminations. In contrast, the thermodynamically dominant (003) facet shows greater resistance to HF interaction, with adsorption remaining predominantly molecular and progressing toward deliquescence only at elevated HF concentrations. Fluorine-rich and charge-balanced terminations on both facets display enhanced stability, characterized by high work functions, minimal ELF redistribution, and suppressed charge transfer. Full article
(This article belongs to the Special Issue Surface and Interface Science in Energy Materials)
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24 pages, 7190 KB  
Article
Effects of Loading Direction on Mechanical Behavior of Core–Shell Cu-Al Nanoparticles Under Uniform Compressive Loading-Molecular Dynamics Study
by Phillip Tomich, Michael Zawadzki and Iman Salehinia
Crystals 2026, 16(3), 186; https://doi.org/10.3390/cryst16030186 - 10 Mar 2026
Viewed by 321
Abstract
The mechanical behavior of metallic core–shell nanoparticles is critical for their use as reinforcement particles and additive manufacturing feedstocks, yet their deformation mechanisms remain incompletely understood. This study employs molecular dynamics simulations to investigate the compressive response of a Cu-core/Al-shell nanoparticle and compares [...] Read more.
The mechanical behavior of metallic core–shell nanoparticles is critical for their use as reinforcement particles and additive manufacturing feedstocks, yet their deformation mechanisms remain incompletely understood. This study employs molecular dynamics simulations to investigate the compressive response of a Cu-core/Al-shell nanoparticle and compares it with solid Cu, solid Al, and a hollow Al shell of the same size under uniaxial loading along ⟨100⟩, ⟨110⟩, ⟨111⟩, and ⟨112⟩ directions. The single-material nanoparticles show strong anisotropy: solid Cu exhibits orientation-dependent transitions from dislocation slip to deformation twinning, while introducing a void to form a hollow Al shell reduces stiffness and strength, confines plasticity to the shell wall, and suppresses extended load-bearing twins. The Cu–Al core–shell nanoparticle combines these behaviors in an orientation-dependent manner. Under ⟨110⟩ and ⟨112⟩ loading, deformation is largely shell-dominated, whereas ⟨100⟩ and ⟨111⟩ loading more strongly activates the Cu core. Mechanistically, ⟨100⟩ is characterized by Shockley partial activity and junction/lock formation in the Al shell coupled with twinning in the Cu core; ⟨110⟩ shows primarily shell partials with limited core involvement; ⟨111⟩ promotes partial-dislocation activity in both shell and core; and ⟨112⟩ produces localized, twin-dominated bands in the Al shell with shell-thickness-dependent twin extension into the Cu core. These trends are rationalized using Schmid factor considerations for 111110 slip and 111112 partial/twinning shear, together with the effects of faceted free surfaces and the Cu–Al interface. The core–shell geometry enables two concurrent interface-mediated pathways, i.e., (i) stress transfer and reduced cross-interface transmission and (ii) circumferential bypass within the shell, which together yield only slight flow-stress increases over solid Al while markedly reducing stress serrations compared with both solid Cu and solid Al. Across all orientations, the core–shell structures also exhibit delayed yielding (higher yield strain) relative to solid Cu, indicating enhanced ductility. The results provide an atomistic basis for designing Cu–Al core–shell nanoparticles for robust particle-based processing and additive manufacturing feedstock, and for informing multiscale models with mechanism-resolved, orientation-dependent inputs. Full article
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21 pages, 5133 KB  
Review
Synergistic Anticancer Effects of Vitamin D and Plant-Derived Compounds: Molecular Mechanisms, Therapeutic Potential, and Nanotechnology-Enabled Delivery Approaches
by Arik Dahan, Sapir Ifrah, Ludmila Yarmolinsky, Boris Khalfin, Sigal Fleisher-Berkovich and Shimon Ben-Shabat
Int. J. Mol. Sci. 2026, 27(5), 2507; https://doi.org/10.3390/ijms27052507 - 9 Mar 2026
Viewed by 472
Abstract
Vitamin D is widely recognized for its pivotal role in the prevention and treatment of various cancers. The active compounds derived from plants have garnered significant attention due to their multi-faceted anticancer properties. Given the complexity and heterogeneity of cancer, monotherapies often fall [...] Read more.
Vitamin D is widely recognized for its pivotal role in the prevention and treatment of various cancers. The active compounds derived from plants have garnered significant attention due to their multi-faceted anticancer properties. Given the complexity and heterogeneity of cancer, monotherapies often fall short in effectiveness. As a result, combinatorial pharmacological strategies, which utilize multiple drug agents, are increasingly being employed globally. Notably, emerging evidence highlights the potent synergistic anticancer effects of vitamin D in combination with certain phytochemicals against a variety of cancers. This review explores the cooperative mechanisms through which vitamin D and phytochemicals enhance cancer prevention and therapy. In addition to examining their synergistic effects, this review also discusses recent advancements in nanotechnology-based delivery systems for vitamin D, which hold promise for optimizing its therapeutic potential. Collectively, these findings underscore the potential of combining vitamin D with phytochemicals and innovative delivery methods as a promising strategy in the fight against cancer, paving the way for more effective, multi-targeted therapeutic approaches. Full article
(This article belongs to the Section Bioactives and Nutraceuticals)
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