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Keywords = optimized hot spot analysis

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14 pages, 5792 KiB  
Article
Weld Formation and Characteristics of Hot-Wire Laser Welding in Aluminum Alloy Narrow-Gap Joints
by Jukkapun Greebmalai, Shun Sadasue, Keita Marumoto, Eakkachai Warinsiriruk and Motomichi Yamamoto
Metals 2025, 15(7), 809; https://doi.org/10.3390/met15070809 - 18 Jul 2025
Viewed by 172
Abstract
This study joins a 20 mm thick 5000-series aluminum alloy using hot-wire insertion combined with narrow-gap laser welding to evaluate the feasibility and welding characteristics of this technique. The findings indicate that weld formation is primarily influenced by the laser energy density and [...] Read more.
This study joins a 20 mm thick 5000-series aluminum alloy using hot-wire insertion combined with narrow-gap laser welding to evaluate the feasibility and welding characteristics of this technique. The findings indicate that weld formation is primarily influenced by the laser energy density and material deposition rate. A strategy for improving weld beads is introduced incorporating a reoriented laser spot during the final pass on narrow-gap joints. This approach improves penetration and produces defect-free joints. The optimal processing conditions result in complete joint formation with four welding passes. Microstructural analysis reveals that the aluminum matrix morphology evolves according to the local thermal history during welding. Measurements show that the weld region is slightly harder than the base metal, whereas slightly lower hardness is observed at the fusion line and inter-pass boundaries, which correlates with the microstructure result. Full article
(This article belongs to the Special Issue Advanced Laser Welding and Joining of Metallic Materials)
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20 pages, 6029 KiB  
Article
Insights into Binding Mechanisms of Potential Inhibitors Targeting PCSK9 Protein via Molecular Dynamics Simulation and Free Energy Calculation
by Xingyu Wu, Xi Zhu, Min Fang, Fenghua Qi, Zhixiang Yin, John Z.H. Zhang, Shihua Luo, Tong Zhu and Ya Gao
Molecules 2025, 30(14), 2962; https://doi.org/10.3390/molecules30142962 - 14 Jul 2025
Viewed by 220
Abstract
The design of small-molecule inhibitors targeting proprotein convertase subtilisin/Kein type 9 (PCSK9) remains a forefront challenge in combating atherosclerosis. While various monoclonal antibodies have achieved clinical success, small-molecule inhibitors are hindered by the unique structural features of the PCSK9 binding interface. In this [...] Read more.
The design of small-molecule inhibitors targeting proprotein convertase subtilisin/Kein type 9 (PCSK9) remains a forefront challenge in combating atherosclerosis. While various monoclonal antibodies have achieved clinical success, small-molecule inhibitors are hindered by the unique structural features of the PCSK9 binding interface. In this study, a potential small-molecule inhibitor was identified through virtual screening, followed by molecular dynamics (MD) simulations to explore the binding mechanisms between the inhibitor and the PCSK9 protein. Binding free energies were calculated using molecular mechanics/Generalized Born surface area (MM/GBSA) with the interaction entropy (IE) method, and critical hot-spot residues were identified via alanine scanning analysis. Key residues, including ARG237, ILE369, ARG194 and PHE379, were revealed to form critical interactions with inhibitor and play dominant roles during the inhibitor’s binding. In addition, the polarization effect was shown to significantly influence PCSK9–ligand binding. The identified inhibitor exhibited highly similar binding patterns with two known active compounds, providing valuable insights for the rational design and optimization of small-molecule inhibitors targeting PCSK9. This work contributes to the development of more effective treatments for hyperlipidemia and associated cardiovascular diseases. Full article
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17 pages, 5158 KiB  
Article
Centrifugal Pumping Force in Oil Injection-Based TMS to Cool High-Power Aircraft Electric Motors
by Giuseppe Di Lorenzo, Diego Giuseppe Romano, Antonio Carozza and Antonio Pagano
Energies 2025, 18(13), 3390; https://doi.org/10.3390/en18133390 - 27 Jun 2025
Viewed by 303
Abstract
One of the challenges of our age is climate change and the ways in which it affects the Earth’s global ecosystem. To face the problems linked to such an issue, the international community has defined actions aimed at the reduction in greenhouse gas [...] Read more.
One of the challenges of our age is climate change and the ways in which it affects the Earth’s global ecosystem. To face the problems linked to such an issue, the international community has defined actions aimed at the reduction in greenhouse gas emissions in several sectors, including the aviation industry, which has been requested to mitigate its environmental impact. Conventional aircraft propulsion systems depend on fossil fuels, significantly contributing to global carbon emissions. For this reason, innovative propulsion technologies are needed to reduce aviation’s impact on the environment. Electric propulsion has emerged as a promising solution among the several innovative technologies introduced to face climate change challenges. It offers, in fact, a pathway to more sustainable air travel by eliminating direct greenhouse gas emissions, enhancing energy efficiency. Unfortunately, integrating electric motors into aircraft is currently a big challenge, primarily due to thermal management-related issues. Efficient heat dissipation is crucial to maintain optimal performance, reliability, and safety of the electric motor, but aeronautic applications are highly demanding in terms of power, so ad hoc Thermal Management Systems (TMSs) must be developed. The present paper explores the design and optimization of a TMS tailored for a megawatt electric motor in aviation, suitable for regional aircraft (~80 pax). The proposed system relies on coolant oil injected through a hollow shaft and radial tubes to directly reach hot spots and ensure effective heat distribution inside the permanent magnet cavity. The goal of this paper is to demonstrate how advanced TMS strategies can enhance operational efficiency and extend the lifespan of electric motors for aeronautic applications. The effectiveness of the radial tube configuration is assessed by means of advanced Computational Fluid Dynamics (CFD) analysis with the aim of verifying that the proposed design is able to maintain system thermal stability and prevent its overheating. Full article
(This article belongs to the Special Issue Power Electronics Technology and Application)
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21 pages, 13494 KiB  
Article
Analysis of the Coupling Trend Between the Urban Agglomeration Development and Land Surface Heat Island Effect: A Case Study of Guanzhong Plain Urban Agglomeration, China
by Xiaogang Feng, Fei Li, Sekhar Somenahalli, Yang Zhao, Meng Li, Zaihui Zhou and Fengxia Li
Sustainability 2025, 17(12), 5239; https://doi.org/10.3390/su17125239 - 6 Jun 2025
Viewed by 538
Abstract
The exploration of the coupling trend between urban agglomeration development (UAD) and land surface temperature (LST) expansion is of great significance, and it is of scientific value for the regulation of the thermal environment of urban agglomerations, the optimization of urban spatial planning, [...] Read more.
The exploration of the coupling trend between urban agglomeration development (UAD) and land surface temperature (LST) expansion is of great significance, and it is of scientific value for the regulation of the thermal environment of urban agglomerations, the optimization of urban spatial planning, and the achievement of sustainable urban development. This study employs an array of remote sensing datasets from multiple sources—employing a multi-faceted approach encompassing an overall coupling situation analysis model, a coordination and evaluation system, a geographically weighted spatial autocorrelation algorithm, and landscape pattern quantification indicators—to explore the mutual feedback mechanism and spatial coupling characterization of LST and UAD in the Guanzhong Plain Urban Agglomeration (GZPUA). The results of the study can provide data support for urban spatial planning and thermal environment regulation. The results indicate the following findings: (1) In the GZPUA, the nighttime light (NTL) and land surface temperature (LST) centroids show a significant tendency toward approaching one another, with a spatial offset decreasing from 45.0 km to 9.1 km at the end, indicating a strengthening trend in the photothermal system’s coupling synergy. (2) The coordination of light and heat in the study area exhibits significant non-equilibrium development, with a dynamic trend of urban development space shifting towards the southwest. It confirms the typical regional response law of rapid urbanization. (3) The Moran’s I index of the photothermal system in the study area increased from 0.289 to 0.335, an increase of 15.9%. The proportion of “high–high” (H-H)/“low–low” (L-L)-type regions with clustering distribution of cold and hot spots reaches 58.01%, and their spatial continuity characteristics are significantly enhanced, indicating a significant trend of spatial structural integration between urban heat island effect and construction land expansion. Full article
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18 pages, 4401 KiB  
Article
Computational Fluid Dynamics Investigation of Flow and Flame Behavior in Natural Gas Burners for Borax Pentahydrate Furnaces
by Mehmed Rafet Ozdemir, Ramazan Sener, İlker Solakoglu and Bahadır Tunaboylu
Processes 2025, 13(6), 1660; https://doi.org/10.3390/pr13061660 - 26 May 2025
Viewed by 720
Abstract
The combustion behavior and thermal performance of industrial-scale borax pentahydrate (Na2B4O7·5H2O) melting furnaces remain underexplored despite their critical role in boric oxide (B2O3) production, a key input for high-performance manufacturing. This [...] Read more.
The combustion behavior and thermal performance of industrial-scale borax pentahydrate (Na2B4O7·5H2O) melting furnaces remain underexplored despite their critical role in boric oxide (B2O3) production, a key input for high-performance manufacturing. This study addressed this gap by employing three-dimensional computational fluid dynamics (CFD) simulations to model two operational natural gas-fired furnaces with distinct burner configurations (four-burner and six-burner systems). The analysis focused on optimizing burner placement, specifically, the axial distance and inclination angle, to enhance thermal uniformity and reduce refractory wall damage caused by aggressive high-temperature borate corrosion. A comprehensive parametric study of twelve burner configurations revealed that tilting the burners at 5–10° significantly improved temperature uniformity while reducing peak wall temperatures and mitigating localized hot spots. The optimal design, incorporating a 10° burner angle and a staggered burner arrangement (Case 11), attained a melt pool temperature of 1831.3 K and a charging average wall temperature of 1812.0 K. These values represent essential benchmarks for maximizing furnace efficiency and operational stability. The modified designs for the four- and six-burner systems led to improved temperature distributions and a notable reduction in maximum wall temperatures, directly contributing to longer maintenance intervals and improved refractory durability. The findings of this study confirm that minor geometrical and angular adjustments in burner placement can yield significant performance gains. The validated CFD approach and proposed design modifications offer a scalable, low-cost strategy for improving combustion efficiency and furnace lifespan in borax processing facilities. Full article
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17 pages, 9344 KiB  
Article
Stress Evaluation of a Maritime A-Frame Using Limited Strain Measurements from a Real Deep-Sea Mining Campaign
by Jiahui Ji, Chunke Ma, Ying Li, Mingqiang Xu, Wei Liu, Hong Zhen, Jiancheng Liu, Shuqing Wang, Lei Li and Lianjin Jiang
J. Mar. Sci. Eng. 2025, 13(5), 897; https://doi.org/10.3390/jmse13050897 - 30 Apr 2025
Viewed by 309
Abstract
As terrestrial resources become increasingly scarce, the exploration and utilization of marine resources have become crucial for ensuring a stable resource supply. A maritime A-Frame is a specialized lifting mechanism mounted on the stern of a vessel, designed for deploying and retrieving heavy [...] Read more.
As terrestrial resources become increasingly scarce, the exploration and utilization of marine resources have become crucial for ensuring a stable resource supply. A maritime A-Frame is a specialized lifting mechanism mounted on the stern of a vessel, designed for deploying and retrieving heavy loads during subsea exploration. Real-time monitoring of the stress of A-Frames is essential for identifying potential failures and preventing accidents. This paper presents a stress-monitoring campaign conducted on a maritime A-Frame during a deep-sea mining project in the South China Sea. Fiber Bragg Grating (FBG) strain sensors were installed on the A-Frame to measure its stress responses throughout the deep-sea mining operation. The stress variations observed during the deployment and retrieval of a deep-sea mining vehicle were analyzed. The results indicate that the stress caused by the swinging motion of the A-Frame was significantly higher than that generated by the lifting and deployment of the mining equipment. Additionally, a finite element model (FEM) of the A-Frame was developed to estimate the stress of the hot spots by integrating the measured strain data. The analysis confirmed that the maximum stress experienced by the A-Frame was well below the allowable threshold, indicating that the structure had sufficient strength to withstand operational loads. In addition, the swing angle of the A-Frame significantly affects the stress value of the A-Frame, while lifting the mining vehicle has a very slight effect. Thus, it is advisable to accelerate the deployment and retrieval speeds of the mining vehicle and minimize the outward swing angle of the A-Frame. These findings provide valuable insights for optimizing the design and ensuring the safe operation of maritime A-Frames in deep-sea mining exploration. Full article
(This article belongs to the Special Issue Deep-Sea Mineral Resource Development Technology and Equipment)
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22 pages, 4571 KiB  
Article
Long-Term Analysis and Multi-Scenarios Simulation of Ecosystem Service Values in Typical Karst River Basins
by Shishu Lian, Anjun Lan, Zemeng Fan, Bingcheng Feng and Kuisong Xiao
Land 2025, 14(4), 824; https://doi.org/10.3390/land14040824 - 10 Apr 2025
Viewed by 481
Abstract
This study, guided by the concept hat “lucid waters and lush mountains are invaluable assets”, focuses on explicating the ecological vulnerability characteristics of the Nanpan and Beipan River Basins, a typical karst river basin in Guizhou Province. In this article, a value equivalent [...] Read more.
This study, guided by the concept hat “lucid waters and lush mountains are invaluable assets”, focuses on explicating the ecological vulnerability characteristics of the Nanpan and Beipan River Basins, a typical karst river basin in Guizhou Province. In this article, a value equivalent table was built to calculate the ecosystem service value (ESV) within the basin from 2000 to 2020. The patch landscape and urban simulation model (PLUS) was improved to forecast ecosystem changes under four scenarios in the future. The Getis-Ord Gi*statistic, a spatial analysis tool, was introduced to identify and interpret the spatial patterns of ESVs in the study area. The research indicates that: (1) from 2000 to 2020, the spatial pattern of ecosystem has significantly improved, and with a notable ESV increase in the Nanpan and Beipan River Basins, especially the fastest growth from 2005 to 2010. Forest and grassland ecosystems are the main contributors to ESV within the basin, and the spatial distribution of ESV shows a decreasing trend from southeast to northwest. (2) Under different scenarios, forest ecosystem still would have the highest contribution rate to update the ESV between 2010 and 2035. The ESV is the lowest under the cropland protection scenario, amounting to CNY 104.972 billion. Compared to other scenarios, the ESV is higher under the sustainable development scenario, reaching CNY 106.786 billion, and this scenario provides a more comprehensive and balanced perspective, relatively achieving a harmonious coexistence between humans and nature. (3) The hot spots of ESV are mainly concentrated in the southeast and along the riverbanks of the study area. Urban ecosystems are the cold spots of ESV, indicating that protecting the ecosystems along the riverbanks is crucial for ensuring the ecological security and sustainable development of karst mountainous river basins. In the future development of karst mountainous river basins, it is necessary to strengthen ecological restoration and governance, monitor soil erosion through remote sensing technology, optimize the layout of territorial space to implement the policy of green development, and promote the harmonious coexistence of humans and nature, ensuring the ecological security and sustainable development of the basins. Full article
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27 pages, 7776 KiB  
Article
The Influence of Urban Landscape Ecology on Emotional Well-Being: A Case Study of Downtown Beijing
by Ziyi Li, Xiaolu Wu, Jing Wu and Huihui Liu
Land 2025, 14(3), 519; https://doi.org/10.3390/land14030519 - 1 Mar 2025
Cited by 2 | Viewed by 1122
Abstract
This study focuses on downtown Beijing to explore the spatial distribution characteristics of emotions and their influencing factors from the perspective of landscape ecology. The research reveals significant spatial agglomeration in the distribution of emotions, with hot spots primarily concentrated around parks, commercial [...] Read more.
This study focuses on downtown Beijing to explore the spatial distribution characteristics of emotions and their influencing factors from the perspective of landscape ecology. The research reveals significant spatial agglomeration in the distribution of emotions, with hot spots primarily concentrated around parks, commercial centers, and areas surrounding social service facilities, such as schools and hospitals. By contrast, historical sites and museums are mostly cold spots for emotions. An analysis of various landscape pattern indices shows that indices such as the spatially explicit index of evenness (SIEI), the largest patch index (LPI), the number of patches (NP), and the Shannon–Wiener diversity index (SIDI) are positively correlated with residents’ emotions. This suggests that evenly distributed landscape elements, large natural patches, a rich variety of landscape types, and high landscape diversity can effectively enhance residents’ emotional well-being. Conversely, complex landscape shape indices and high aggregation indices may negatively impact emotions. Based on these findings, it is recommended that urban planning optimize the urban green space system, increase the area and number of natural patches, pay attention to the diversity of landscape design, simplify the shape of the landscape, and reasonably control the aggregation of the landscape to create a more emotionally caring urban space. Full article
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23 pages, 11295 KiB  
Article
Spatiotemporal Heterogeneity and Zoning Strategies of Multifunctional Trade-Offs and Synergies in Cultivated Land in the Hexi Corridor
by Kaichun Zhou, Zixiang Sun, Tingting Ma, Yulin Li and Binggeng Xie
Land 2025, 14(2), 335; https://doi.org/10.3390/land14020335 - 7 Feb 2025
Cited by 1 | Viewed by 768
Abstract
As the indispensable basic resource of agricultural production, cultivated land has always carried the important mission of maintaining food stability, promoting rural economic development, and maintaining ecological balance. However, in application, there is often a conflict between the multiple functions of cultivated land [...] Read more.
As the indispensable basic resource of agricultural production, cultivated land has always carried the important mission of maintaining food stability, promoting rural economic development, and maintaining ecological balance. However, in application, there is often a conflict between the multiple functions of cultivated land and the limited ability of cultivated land to perform multiple functions. Therefore, this paper uses hot spot analysis, the IUEMS model, the InVEST model, Pearson correlation coefficients and self-organizing feature maps (SOFMs) to explore the multifunctional trade-offs and synergistic relationships of cultivated land in the Hexi Corridor at the grid scale and the zoning optimization scheme. The results revealed that from 2000 to 2020, the cultivated land production functions and social security functions in the Hexi Corridor maintained a high level and continued to rise, and the hot spots exhibited a stable pattern of “central and southeast concentration”. The ecological function performance is relatively weak, and the hot spots are concentrated mainly in the southeast, whereas the landscape view recreational functions as a whole show a trend of gradual recovery after weakening. In terms of mutual relationships, there are significant synergies between cultivated land production and social security functions, whereas the trade-offs and synergies between other functions are complex and changeable. Production and social security show a coordinated spatial distribution pattern. Production, social security, and ecological functions are dominated by spatial trade-offs. The production and landscape recreation functions, social security and ecological functions, social security and landscape recreation functions, and ecological and landscape recreation functions are mainly synergistic in space. Through self-organizing feature map analysis, the cultivated land in the Hexi Corridor is divided into four functional areas: agricultural production-dominant areas, agricultural social security areas, ecological agriculture areas, and balanced development areas, and management objectives are proposed. This study can provide useful lessons and references for land use planning and management in other similar areas. Full article
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22 pages, 7826 KiB  
Article
Smart Urban Forest Initiative: Nature-Based Solution and People-Centered Approach for Tree Management in Chiang Mai, Thailand
by Nattasit Srinurak, Warong Wonglangka and Janjira Sukwai
Sustainability 2024, 16(24), 11078; https://doi.org/10.3390/su162411078 - 17 Dec 2024
Cited by 4 | Viewed by 2437
Abstract
This research created urban forest management using GIS as the primary instrument to act as a combined technique that allows the locals to participate in the survey. To maintain a sustainable urban green, urban tree management is necessary to reduce complexity and conflict. [...] Read more.
This research created urban forest management using GIS as the primary instrument to act as a combined technique that allows the locals to participate in the survey. To maintain a sustainable urban green, urban tree management is necessary to reduce complexity and conflict. The initiative used a nature-based solution for tree care depending on species combined with a people-centered smart city approach to better assess tree health in historic urban areas. A total of 4607 records were obtained from the field survey event utilizing a mobile application as a tool. The tree’s basic name, spatial character, position, and potential risk were all gathered during the field survey. As GIS converted the tree’s general or local name into its scientific name, it was able to view and evaluate the data. The findings indicate that trees are most in danger from animals and insects, accounting for 56.39% (2748) of the total risk. Most of them are in areas with poor soil suitability. Through optimized hot-spot analysis mapping, the study recommended that tree care be prioritized. Maps of tree blooming and fruiting indicate the possibility of enhancing the advantages of urban trees in the research region in accordance with their phenological patterns. Full article
(This article belongs to the Special Issue GIS Implementation in Sustainable Urban Planning)
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18 pages, 4524 KiB  
Article
Evolution of Spatial Patterns and Influencing Factors of Sports Tourism Development in Yangtze River Delta Region
by Pengfei Tai, Maoteng Cheng, Fugao Jiang, Zhaojin Li and Qiaojing Wang
Sustainability 2024, 16(24), 11028; https://doi.org/10.3390/su162411028 - 16 Dec 2024
Cited by 1 | Viewed by 1154
Abstract
The development of sports tourism is of great significance in promoting regional cultural exchanges, boosting economic development, accelerating the construction of national fitness, promoting the development of the sports industry, and advancing ecological environmental protection. With the integrated application of exploratory spatial data [...] Read more.
The development of sports tourism is of great significance in promoting regional cultural exchanges, boosting economic development, accelerating the construction of national fitness, promoting the development of the sports industry, and advancing ecological environmental protection. With the integrated application of exploratory spatial data analysis and gray correlation analysis model, this article takes the Yangtze River Delta region as the research object and comprehensively explores the pattern evolution characteristics and influencing factors of its sports tourism development space. The study found that (1) the total amount of sports tourism resources in the Yangtze River Delta region has accumulated in fluctuation and iteration, and the types are constantly enriched; (2) the spatial pattern of sports tourism resources in the Yangtze River Delta region shows the evolution characteristics of “agglomeration–dispersion–agglomeration” over time; (3) the spatial evolution hot spots of sports tourism resources in the Yangtze River Delta region have experienced the following characteristics “unipolar-multipolar-area-wide-suburban”, and the center of gravity of spatial evolution has experienced the process of east–west linear development and north–south diffusion; and (4) the spatial development of sports tourism in the Yangtze River Delta region has experienced the process of “policy + sports + transportation” drive, “economic + social” drive, economic drive, and total-factor drive in different periods. The results of the study can help optimize the allocation of sports and tourism resources in the Yangtze River Delta region, further realize the in-depth integration and development of sports, culture, and tourism, and enhance the regional economy and public service level. Full article
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25 pages, 6719 KiB  
Article
Ecosystem Services’ Response to Land Use Intensity: A Case Study of the Hilly and Gully Region in China’s Loess Plateau
by Zhongqian Zhang, Huanli Pan, Yaqun Liu and Shuangqing Sheng
Land 2024, 13(12), 2039; https://doi.org/10.3390/land13122039 - 28 Nov 2024
Cited by 4 | Viewed by 1184
Abstract
The hilly and gully region of the Loess Plateau represents one of China’s most ecologically vulnerable landscapes, characterized by severe soil erosion, intensive land use, and pronounced disturbances to the structure and functionality of ecosystem services. Taking Zichang City as a case study, [...] Read more.
The hilly and gully region of the Loess Plateau represents one of China’s most ecologically vulnerable landscapes, characterized by severe soil erosion, intensive land use, and pronounced disturbances to the structure and functionality of ecosystem services. Taking Zichang City as a case study, this research integrates grid-scale analysis with the InVEST-PLUS model and bivariate spatial autocorrelation techniques to examine the spatiotemporal dynamics and inter-relations of four critical ecosystem services—carbon storage, water yield, biodiversity, and soil retention—under varying land use intensity scenarios from 1990 to 2035. The findings indicate that (1) between 1990 and 2020, land use intensity in Zichang City steadily declined, exhibiting a spatial distribution pattern typified by central-area clustering and gradual peripheral transitions. (2) Across three development scenarios, the spatial distribution of the four ecosystem services aligned with the patterns observed in 2020, with central areas showing pronounced fluctuations, whereas peripheral regions experienced relatively minor changes. Specifically, from 1990 to 2020, the proportion of low-carbon storage areas increased by 2.89%, and high water yield areas expanded by 9.45%, while the shares of low habitat quality and low soil retention areas decreased by 5.59% and 6.25%, respectively. (3) A significant spatial autocorrelation was observed between land use intensity and the four ecosystem services, with widespread cold and hot spots reflecting dynamic spatial clustering patterns. These results offer valuable insights for optimizing land use strategies, improving ecosystem service performance, and advancing ecological conservation and sustainable development initiatives. Full article
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45 pages, 11195 KiB  
Review
Exploring Plasmonic Standalone Surface-Enhanced Raman Scattering Nanoprobes for Multifaceted Applications in Biomedical, Food, and Environmental Fields
by Valentina Rojas Martínez, Eunseo Lee and Jeong-Wook Oh
Nanomaterials 2024, 14(22), 1839; https://doi.org/10.3390/nano14221839 - 17 Nov 2024
Cited by 7 | Viewed by 3406
Abstract
Surface-enhanced Raman scattering (SERS) is an innovative spectroscopic technique that amplifies the Raman signals of molecules adsorbed on rough metal surfaces, making it pivotal for single-molecule detection in complex biological and environmental matrices. This review aims to elucidate the design strategies and recent [...] Read more.
Surface-enhanced Raman scattering (SERS) is an innovative spectroscopic technique that amplifies the Raman signals of molecules adsorbed on rough metal surfaces, making it pivotal for single-molecule detection in complex biological and environmental matrices. This review aims to elucidate the design strategies and recent advancements in the application of standalone SERS nanoprobes, with a special focus on quantifiable SERS tags. We conducted a comprehensive analysis of the recent literature, focusing on the development of SERS nanoprobes that employ novel nanostructuring techniques to enhance signal reliability and quantification. Standalone SERS nanoprobes exhibit significant enhancements in sensitivity and specificity due to optimized hot spot generation and improved reporter molecule interactions. Recent innovations include the development of nanogap and core–satellite structures that enhance electromagnetic fields, which are crucial for SERS applications. Standalone SERS nanoprobes, particularly those utilizing indirect detection mechanisms, represent a significant advancement in the field. They hold potential for wide-ranging applications, from disease diagnostics to environmental monitoring, owing to their enhanced sensitivity and ability to operate under complex sample conditions. Full article
(This article belongs to the Special Issue Versatile Plasmonic Nanostructures for Biomedical Applications)
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14 pages, 4077 KiB  
Article
Sensitive Detection of Fungicide Folpet by Surface-Enhanced Raman Scattering: Experimental and Theoretical Approach
by Oumaima Douass, Bousselham Samoudi and Santiago Sanchez-Cortes
Chemosensors 2024, 12(9), 186; https://doi.org/10.3390/chemosensors12090186 - 12 Sep 2024
Viewed by 1328
Abstract
In this work, Surface-Enhanced Raman Spectroscopy (SERS) was employed as an effective detection technique for folpet, characterized by its notable specificity and sensitivity. The investigation involved the use of UV–Vis, Raman, and SERS spectroscopy of folpet at different concentrations for a comprehensive study [...] Read more.
In this work, Surface-Enhanced Raman Spectroscopy (SERS) was employed as an effective detection technique for folpet, characterized by its notable specificity and sensitivity. The investigation involved the use of UV–Vis, Raman, and SERS spectroscopy of folpet at different concentrations for a comprehensive study of plasmon-driven effects such as plasmon resonance, plasmon hybridization, and electric field enhancement resulting in the SERS’ intensification. Specifically, SERS detection of folpet solutions at concentrations below 100 µM is presented in detail by using Ag nanoparticles prepared with hydroxylamine reduction. The experimentation encompassed diverse conditions to optimize the detection process, with Raman spectra acquired for both folpet powder and aqueous solution of folpet at the natural pH. SERS analyses were conducted across a concentration range of 9.5 × 10−8 to 1.61 × 10−4 M, employing 532 nm excitation. The differences in the spectral profiles observed for folpet Raman powder and SERS are ascribed to N–S cleavage; these changes are attributed to plasmon catalysis induced by the used Ag nanoparticles. Transmission electron microscopy (TEM) was also important in the present analysis to better understand which mechanism of nanoparticles aggregation is more favorable for the SERS detection regarding the formation of hot spots in the suspension. Complementing the experimental data, the molecular structure and theoretical Raman spectra of the folpet molecule were calculated through density functional theory (DFT) methods. The outcomes of these calculations were crucial in the elucidation of folpet’s vibrational modes. The culmination of this research resulted in the successful detection of folpet, achieving a notable limit of detection at 4.78 × 10−8 M. This comprehensive approach amalgamates experimental and theoretical methodologies, offering significant insights into the detection capabilities and molecular characteristics of folpet via SERS analysis. Full article
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15 pages, 2780 KiB  
Article
Enhanced Sensitivity and Homogeneity of SERS Signals on Plasmonic Substrate When Coupled to Paper Spray Ionization–Mass Spectrometry
by Adewale A. Adehinmoye, Ebenezer H. Bondzie, Jeremy D. Driskell, Christopher C. Mulligan and Jun-Hyun Kim
Chemosensors 2024, 12(9), 175; https://doi.org/10.3390/chemosensors12090175 - 2 Sep 2024
Cited by 1 | Viewed by 1995
Abstract
This work reports on the development of an analyte sampling strategy on a plasmonic substrate to amplify the detection capability of a dual analytical system, paper spray ionization–mass spectrometry (PSI-MS) and surface-enhanced Raman spectroscopy (SERS). While simply applying only an analyte solution to [...] Read more.
This work reports on the development of an analyte sampling strategy on a plasmonic substrate to amplify the detection capability of a dual analytical system, paper spray ionization–mass spectrometry (PSI-MS) and surface-enhanced Raman spectroscopy (SERS). While simply applying only an analyte solution to the plasmonic paper results in a limited degree of SERS enhancement, the introduction of plasmonic gold nanoparticles (AuNPs) greatly improves the SERS signals without sacrificing PSI-MS sensitivity. It is initially revealed that the concentration of AuNPs and the type of analytes highly influence the SERS signals and their variations due to the “coffee ring effect” flow mechanism induced during sampling and the degree of the interfacial interactions (e.g., van der Waals, electrostatic, covalent) between the plasmonic substrate and analyte. Subsequent PSI treatment at high voltage conditions further impacts the overall SERS responses, where the signal sensitivity and homogeneity significantly increase throughout the entire substrate, suggesting the ready migration of adsorbed analytes regardless of their interfacial attractive forces. The PSI-induced notable SERS enhancements are presumably associated with creating unique conditions for local aggregation of the AuNPs to induce effective plasmonic couplings and hot spots (i.e., electromagnetic effect) and for repositioning analytes in close proximity to a plasmonic surface to increase polarizability (i.e., chemical effect). The optimized sampling and PSI conditions are also applicable to multi-analyte analysis by SERS and MS, with greatly enhanced detection capability and signal uniformity. Full article
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