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16 pages, 2656 KiB  
Article
Plastic Film Mulching Regulates Soil Respiration and Temperature Sensitivity in Maize Farming Across Diverse Hydrothermal Conditions
by Jianjun Yang, Rui Wang, Xiaopeng Shi, Yufei Li, Rafi Ullah and Feng Zhang
Agriculture 2025, 15(15), 1667; https://doi.org/10.3390/agriculture15151667 (registering DOI) - 1 Aug 2025
Abstract
Soil respiration (Rt), consisting of heterotrophic (Rh) and autotrophic respiration (Ra), plays a vital role in terrestrial carbon cycling and is sensitive to soil temperature and moisture. In dryland agriculture, plastic film mulching (PM) is widely used to regulate soil hydrothermal conditions, but [...] Read more.
Soil respiration (Rt), consisting of heterotrophic (Rh) and autotrophic respiration (Ra), plays a vital role in terrestrial carbon cycling and is sensitive to soil temperature and moisture. In dryland agriculture, plastic film mulching (PM) is widely used to regulate soil hydrothermal conditions, but its effects on Rt components and their temperature sensitivity (Q10) across regions remain unclear. A two-year field study was conducted at two rain-fed maize sites: Anding (warmer, semi-arid) and Yuzhong (colder, drier). PM significantly increased Rt, Rh, and Ra, especially Ra, due to enhanced root biomass and improved microclimate. Yield increased by 33.6–165%. Peak respiration occurred earlier in Anding, aligned with maize growth and soil temperature. PM reduced Q10 of Rt and Ra in Anding, but only Ra in Yuzhong. Rh Q10 remained stable, indicating microbial respiration was less sensitive to temperature changes. Structural equation modeling revealed that Rt and Ra were mainly driven by soil temperature and root biomass, while Rh was more influenced by microbial biomass carbon (MBC) and dissolved organic carbon (DOC). Despite increased CO2 emissions, PM improved carbon emission efficiency (CEE), particularly in Yuzhong (+67%). The application of PM is recommended to enhance yield while optimizing carbon efficiency in dryland farming systems. Full article
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32 pages, 6657 KiB  
Article
Mechanisms of Ocean Acidification in Massachusetts Bay: Insights from Modeling and Observations
by Lu Wang, Changsheng Chen, Joseph Salisbury, Siqi Li, Robert C. Beardsley and Jackie Motyka
Remote Sens. 2025, 17(15), 2651; https://doi.org/10.3390/rs17152651 (registering DOI) - 31 Jul 2025
Viewed by 115
Abstract
Massachusetts Bay in the northeastern United States is highly vulnerable to ocean acidification (OA) due to reduced buffering capacity from significant freshwater inputs. We hypothesize that acidification varies across temporal and spatial scales, with short-term variability driven by seasonal biological respiration, precipitation–evaporation balance, [...] Read more.
Massachusetts Bay in the northeastern United States is highly vulnerable to ocean acidification (OA) due to reduced buffering capacity from significant freshwater inputs. We hypothesize that acidification varies across temporal and spatial scales, with short-term variability driven by seasonal biological respiration, precipitation–evaporation balance, and river discharge, and long-term changes linked to global warming and river flux shifts. These patterns arise from complex nonlinear interactions between physical and biogeochemical processes. To investigate OA variability, we applied the Northeast Biogeochemistry and Ecosystem Model (NeBEM), a fully coupled three-dimensional physical–biogeochemical system, to Massachusetts Bay and Boston Harbor. Numerical simulation was performed for 2016. Assimilating satellite-derived sea surface temperature and sea surface height improved NeBEM’s ability to reproduce observed seasonal and spatial variability in stratification, mixing, and circulation. The model accurately simulated seasonal changes in nutrients, chlorophyll-a, dissolved oxygen, and pH. The model results suggest that nearshore areas were consistently more susceptible to OA, especially during winter and spring. Mechanistic analysis revealed contrasting processes between shallow inner and deeper outer bay waters. In the inner bay, partial pressure of pCO2 (pCO2) and aragonite saturation (Ωa) were influenced by sea temperature, dissolved inorganic carbon (DIC), and total alkalinity (TA). TA variability was driven by nitrification and denitrification, while DIC was shaped by advection and net community production (NCP). In the outer bay, pCO2 was controlled by temperature and DIC, and Ωa was primarily determined by DIC variability. TA changes were linked to NCP and nitrification–denitrification, with DIC also influenced by air–sea gas exchange. Full article
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12 pages, 3886 KiB  
Article
Effect of W Contents and Annealing Temperatures on the Microstructure and Mechanical Properties of CoFeNi Medium Entropy Alloys
by Yaqi Cui, Huan Ma, Li Yang, Yang Shao and Renguo Guan
Metals 2025, 15(8), 854; https://doi.org/10.3390/met15080854 - 30 Jul 2025
Viewed by 117
Abstract
In this work, the W element, with a larger atomic radius compared to Co, Fe, and Ni, was added to modify the microstructure and enhance the yield strength of CoFeNi medium entropy alloy (MEA). A detailed study was conducted to clarify the effects [...] Read more.
In this work, the W element, with a larger atomic radius compared to Co, Fe, and Ni, was added to modify the microstructure and enhance the yield strength of CoFeNi medium entropy alloy (MEA). A detailed study was conducted to clarify the effects of W additions and annealing temperatures on the microstructure evolution and mechanical properties of CoFeNiWx (x = 0, 0.1, and 0.3) MEAs. CoFeNiW0.1 retained a single FCC structure without the formation of precipitates in the FCC phase, indicating that W, with a larger atomic radius, can completely dissolve in CoFeNiW0.1. For CoFeNiW0.3 MEA, coarse particles with an average diameter of ~2 μm appeared after homogenizing. Nevertheless, when the alloy was annealed at 800 °C and 900 °C, fine particles formed, with the average diameters of approximately 144 nm and 225 nm, respectively. After annealing at 800 °C, the CoFeNiW0.3 with a partially recrystallized microstructure exhibited better comprehensive mechanical properties. Full article
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17 pages, 3944 KiB  
Article
Functionalized Magnetic Nanoparticles as Recyclable Draw Solutes for Forward Osmosis: A Sustainable Approach to Produced Water Reclamation
by Sunith B. Madduri and Raghava R. Kommalapati
Separations 2025, 12(8), 199; https://doi.org/10.3390/separations12080199 - 29 Jul 2025
Viewed by 181
Abstract
Magnetic nanoparticles (MNPs), especially iron oxide (Fe3O4), display distinctive superparamagnetic characteristics and elevated surface-area-to-volume ratios, facilitating improved physicochemical interactions with solutes and pollutants. These characteristics make MNPs strong contenders for use in water treatment applications. This research investigates the [...] Read more.
Magnetic nanoparticles (MNPs), especially iron oxide (Fe3O4), display distinctive superparamagnetic characteristics and elevated surface-area-to-volume ratios, facilitating improved physicochemical interactions with solutes and pollutants. These characteristics make MNPs strong contenders for use in water treatment applications. This research investigates the application of iron oxide MNPs synthesized via co-precipitation as innovative draw solutes in forward osmosis (FO) for treating synthetic produced water (SPW). The FO membrane underwent surface modification with sulfobetaine methacrylate (SBMA), a zwitterionic polymer, to increase hydrophilicity, minimize fouling, and elevate water flux. The SBMA functional groups aid in electrostatic repulsion of organic and inorganic contaminants, simultaneously encouraging robust hydration layers that improve water permeability. This adjustment is vital for sustaining consistent flux performance while functioning with MNP-based draw solutions. Material analysis through thermogravimetric analysis (TGA), scanning electron microscopy (SEM), and Fourier-transform infrared spectroscopy (FTIR) verified the MNPs’ thermal stability, consistent morphology, and modified surface chemistry. The FO experiments showed a distinct relationship between MNP concentration and osmotic efficiency. At an MNP dosage of 10 g/L, the peak real-time flux was observed at around 3.5–4.0 L/m2·h. After magnetic regeneration, 7.8 g of retrieved MNPs generated a steady flow of ~2.8 L/m2·h, whereas a subsequent regeneration (4.06 g) resulted in ~1.5 L/m2·h, demonstrating partial preservation of osmotic driving capability. Post-FO draw solutions, after filtration, exhibited total dissolved solids (TDS) measurements that varied from 2.5 mg/L (0 g/L MNP) to 227.1 mg/L (10 g/L MNP), further validating the effective dispersion and solute contribution of MNPs. The TDS of regenerated MNP solutions stayed similar to that of their fresh versions, indicating minimal loss of solute activity during the recycling process. The combined synergistic application of SBMA-modified FO membranes and regenerable MNP draw solutes showcases an effective and sustainable method for treating produced water, providing excellent water recovery, consistent operational stability, and opportunities for cyclic reuse. Full article
(This article belongs to the Section Purification Technology)
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15 pages, 2018 KiB  
Article
Study on Preparation and Properties of Super Absorbent Gels of Homogenous Cotton Straw-Acrylic Acid-Acrylamide by Graft Copolymerization
by Jun Guo, Jing Shi, Lisheng Xu, Xingtao Zhang, Fangkai Han and Minwei Xu
Gels 2025, 11(8), 583; https://doi.org/10.3390/gels11080583 - 28 Jul 2025
Viewed by 118
Abstract
To rationally utilize and develop agricultural waste products, this research involved the synthesis of degradable high water-absorbing resin through the graft copolymerization of cotton straw (CS) with monomers. Among them, acrylic acid (AA) and acrylamide (Am) are used as grafting copolymer monomers, cellulose [...] Read more.
To rationally utilize and develop agricultural waste products, this research involved the synthesis of degradable high water-absorbing resin through the graft copolymerization of cotton straw (CS) with monomers. Among them, acrylic acid (AA) and acrylamide (Am) are used as grafting copolymer monomers, cellulose in the straw serves as the network framework, and MBA acts as the crosslinking agent. 60Co gamma rays as initiators. Different concentrations of alkaline solution were used to dissolve the cellulose in the straw. Single-factor and orthogonal experiments were conducted to optimize the experimental conditions. various analytical methods such as thermogravimetric analysis (TG), X-ray crystallography (XRD), infrared spectroscopy (IR), and scanning electron microscopy (SEM) were employed to characterize the structure and properties of the product. 60Co gamma rays as initiators, can reduce the pollution caused by chemical initiators and lower energy consumption. Through this research, agricultural waste can be effectively utilized, reducing environmental pollution, lowering industrial energy consumption, and synthesizing degradable and environmentally friendly high-absorbent resins. The product can be applied to agricultural water retention agent, fertilizer controlled release agent and other aspects. Full article
(This article belongs to the Special Issue Cellulose-Based Hydrogels for Advanced Applications)
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20 pages, 6464 KiB  
Article
Bacterial Communities Respond to Spatiotemporal Fluctuation in Water Quality and Microcystins at Lake Taihu
by Aimin Hao, Dong Xia, Xingping Mou, Sohei Kobayashi, Tomokazu Haraguchi, Yasushi Iseri and Min Zhao
Water 2025, 17(15), 2222; https://doi.org/10.3390/w17152222 - 25 Jul 2025
Viewed by 262
Abstract
Microbial communities are crucial to maintaining the ecological health of lakes, but their response to water quality and eutrophication is poorly understood. This study analyzed seasonal variation in the effect of water quality parameters on microbial community structure and function at southern Lake [...] Read more.
Microbial communities are crucial to maintaining the ecological health of lakes, but their response to water quality and eutrophication is poorly understood. This study analyzed seasonal variation in the effect of water quality parameters on microbial community structure and function at southern Lake Taihu. We observed poor water quality in autumn (low dissolved oxygen concentration and water transparency) with severe eutrophication (high in nitrogen, phosphorus, and microcystins). Microcystins were a major indicator of water quality that affected total phosphorus and dissolved oxygen concentrations. Redundancy analysis revealed that total nitrogen, total phosphorus, nitrate, ammonium, and microcystins, temperature, and dissolved oxygen all significantly influenced the microbial community. Microbial co-occurrence networks revealed significant seasonal variations, with autumn and winter exhibiting a more complex structure than other seasons. Additionally, we identified microcystin-sensitive microbial species as eutrophication indicators; they are involved in bacterial community components and metabolic function and fluctuate under seasonal changes to water quality. In conclusion, our findings provide insight into the relationship between water quality and microbial communities, offering an empirical basis for improving the sustainable management of Lake Taihu. Full article
(This article belongs to the Section Biodiversity and Functionality of Aquatic Ecosystems)
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16 pages, 2234 KiB  
Article
Impact of Co-Presence of Endotoxins and Microplastics on Seawater Biophysicochemical Indicators
by Hasan Saygin and Asli Baysal
Int. J. Mol. Sci. 2025, 26(15), 7178; https://doi.org/10.3390/ijms26157178 - 25 Jul 2025
Viewed by 134
Abstract
Micro/nanoplastics (MNP) and endotoxin, typical emerging contaminants, can be found in marine aqueous systems due to various natural and anthropogenic activities, and their co-occurrence may influence the biophysicochemical characteristics of seawater. Moreover, endotoxins may be transported by the micro/nanoplastics or increase the deformation [...] Read more.
Micro/nanoplastics (MNP) and endotoxin, typical emerging contaminants, can be found in marine aqueous systems due to various natural and anthropogenic activities, and their co-occurrence may influence the biophysicochemical characteristics of seawater. Moreover, endotoxins may be transported by the micro/nanoplastics or increase the deformation of these substances, comprising other risks to the ecosystem. However, the impacts of the co-occurrence of micro/nanoplastics and endotoxins in seawater remain unknown. We studied the effects of endotoxin at three concentration levels in seawater and its combined impact with micro/nanoplastics at three doses on biophysicochemical processes in seawater through spectroscopic analysis, leaching indicators (turbidity and humidification index), oxidative potential, antioxidant activity, and biofilm production. The results showed that the UV–VIS spectra of seawater changed with their co-occurrence. The co-presence of MNPs and endotoxins increased the turbidity in seawater, indicating the leaching of micro/nanoplastic in the presence of endotoxins. A higher humification index in seawater showed the formation of dissolved organic substances in micro/nanoplastic and endotoxin seawater compared to the results for untreated seawater. Dithioerythritol assay revealed the differences in oxidative potentials of plain seawater and seawater in the co-presence of micro/nanoplastics and endotoxins. An important biochemical reaction in seawater was tested using biofilm formation. The results showed higher biofilm formation in their co-presence. This study provides new insights into the effects of micro/nanoplastics and their composite pollution with endotoxins on biophysiochemical indicators in seawater. Full article
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23 pages, 2483 KiB  
Article
A Unionid Mussel Biodiversity Hotspot Experiencing Unexplained Declines: Evaluating the Influence of Chemical Stressors Using Caged Juveniles
by W. Aaron Wilson, Christine Bergeron, Jennifer Archambault, Jason Unrine, Jess Jones, Braven Beaty, Damian Shea, Peter R. Lazaro, Jody L. Callihan, Jennifer J. Rogers and W. Gregory Cope
Diversity 2025, 17(8), 503; https://doi.org/10.3390/d17080503 - 22 Jul 2025
Viewed by 281
Abstract
Unionid mussel populations in a section of the Clinch River in Virginia, USA, has declined substantially, but the causes of the decline remain unknown. To investigate this zone of decline (ZOD), we deployed juvenile freshwater mussels (Villosa iris in 2012 and Lampsilis [...] Read more.
Unionid mussel populations in a section of the Clinch River in Virginia, USA, has declined substantially, but the causes of the decline remain unknown. To investigate this zone of decline (ZOD), we deployed juvenile freshwater mussels (Villosa iris in 2012 and Lampsilis fasciola in 2013) in both cages and silos at sites within the Clinch River System. We analyzed mussel tissues for trace element and organic contaminant concentrations, shells for trace elements, and environmental media (total water, dissolved water, particulate sediment, and bedload sediment) for both inorganic and organic contaminants. We found a few differences between mussels deployed in cages and those deployed in silos: survival was slightly lower in cages due to periodic sedimentation. Our results identified the ZOD based on the accumulation of trace elements (notably As, Cu, Fe, Mn, Ni, and Sr), polycyclic aromatic hydrocarbons (PAHs), and δ15N enrichment, with especially high concentrations found in the human-impacted tributaries, Dumps Creek and Guest River. Some correlations were found between environmental media and both mussel tissues and shells. In particular, PAHs and Mn had several significant relationships between bioaccumulated concentrations and environmental concentrations. Finally, Co, Cu, Fe, and V in soft tissues negatively correlated with mussel growth, whereas bioaccumulated PAH concentrations correlated negatively with resident mussel densities. Full article
(This article belongs to the Special Issue Freshwater Biodiversity Hotspots in 2025)
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17 pages, 1390 KiB  
Article
Microbial Valorization of Sunflower Husk for Sustainable Biohydrogen and Biomass Production
by Liana Vanyan, Akerke Toleugazykyzy, Kaisar Yegizbay, Ayaulym Daniyarova, Lyudmila Zuloyan, Gayane Mikoyan, Anait Vassilian, Anna Poladyan, Kairat Bekbayev and Karen Trchounian
Energies 2025, 18(14), 3885; https://doi.org/10.3390/en18143885 - 21 Jul 2025
Viewed by 281
Abstract
Various pretreatment methods for the valorization of sunflower husks (SHs) for H2 gas generation through fermentation by Escherichia coli were investigated. We analyzed thermal treatment (TT), acid hydrolysis (AH), and alkaline hydrolysis (AlkH) at different substrate concentrations (50 g L−1, [...] Read more.
Various pretreatment methods for the valorization of sunflower husks (SHs) for H2 gas generation through fermentation by Escherichia coli were investigated. We analyzed thermal treatment (TT), acid hydrolysis (AH), and alkaline hydrolysis (AlkH) at different substrate concentrations (50 g L−1, 75 g L−1, 100 g L−1, and 150 g L−1) and dilution levels (undiluted, 2× diluted, and 5× diluted). A concentration of 75 g L−1 SH that was acid-hydrolyzed and dissolved twice in the medium yielded optimal microbial growth, reaching 0.3 ± 0.1 g cell dry weight (CDW) L−1 biomass. The highest substrate level enabling effective fermentation was 100 g L−1, producing 0.37 ± 0.13 (g CDW) × L−1 biomass after complete fermentation, while 150 g L−1 exhibited pronounced inhibitory effects. It is worth mentioning that the sole alkaline treatment was not optimal for growth and H2 production. Co-fermentation with glycerol significantly enhanced both biomass formation (up to 0.42 ± 0.15 (g CDW) × L−1)) and H2 production. The highest H2 yield was observed during batch growth at 50 g L−1 SH hydrolysate with 5× dilution, reaching up to 5.7 mmol H2 (g sugar)−1 with glycerol supplementation. This study introduces a dual-waste valorization strategy that combines agricultural and biodiesel industry residues to enhance clean energy generation. The novelty lies in optimizing pretreatment and co-substrate fermentation conditions to maximize both biohydrogen yield and microbial biomass using E. coli, a widely studied and scalable host. Full article
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21 pages, 3984 KiB  
Article
Organic Acid Leaching of Black Mass with an LFP and NMC Mixed Chemistry
by Marc Simon Henderson, Chau Chun Beh, Elsayed Oraby and Jacques Eksteen
Recycling 2025, 10(4), 145; https://doi.org/10.3390/recycling10040145 - 21 Jul 2025
Viewed by 364
Abstract
There is an increasing demand for the development of efficient and sustainable battery recycling processes. Currently, many recycling processes rely on toxic inorganic acids to recover materials from high-value battery chemistries such as lithium nickel manganese cobalt oxides (NMCs) and lithium cobalt oxide [...] Read more.
There is an increasing demand for the development of efficient and sustainable battery recycling processes. Currently, many recycling processes rely on toxic inorganic acids to recover materials from high-value battery chemistries such as lithium nickel manganese cobalt oxides (NMCs) and lithium cobalt oxide (LCOs). However, as cell manufacturers seek more cost-effective battery chemistries, the value of the spent battery value chain is increasingly diluted by chemistries such as lithium iron phosphate (LFPs). These cheaper alternatives present a difficulty when recycling, as current recycling processes are geared towards dealing with high-value chemistries; thus, the current processes become less economical. To date, much research is focused on treating a single battery chemistry; however, often, the feed material entering a battery recycling facility is contaminated with other battery chemistries, e.g., LFP feed contaminated with NMC, LCO, or LMOs. This research aims to selectively leach various battery chemistries out of a mixed feed material with the aid of a green organic acid, namely oxalic acid. When operating at the optimal conditions (2% solids, 0.25 M oxalic acid, natural pH around 1.15, 25 °C, 60 min), this research has proven that oxalic acid can be used to selectively dissolve 95.58% and 93.57% of Li and P, respectively, from a mixed LFP-NMC mixed feed, all while only extracting 12.83% of Fe and 8.43% of Mn, with no Co and Ni being detected in solution. Along with the high degree of selectivity, this research has also demonstrated, through varying the pH, that the selectivity of the leaching system can be altered. It was determined that at pH 0.5 the system dissolved both the NMC and LFP chemistries; at a pH of 1.15, the LFP chemistry (Li and P) was selectively targeted. Finally, at a pH of 4, the NMC chemistry (Ni, Co and Mn) was selectively dissolved. Full article
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7 pages, 4461 KiB  
Data Descriptor
Dataset on Environmental Parameters and Greenhouse Gases in Port and Harbor Seawaters of Jeju Island, Korea
by Jae-Hyun Lim, Ju-Hyoung Kim, Hyo-Ryeon Kim, Seo-Young Kim and Il-Nam Kim
Data 2025, 10(7), 118; https://doi.org/10.3390/data10070118 - 19 Jul 2025
Viewed by 301
Abstract
This dataset presents environmental observations collected in August 2021 from 18 port and harbor sites located around Jeju Island, Korea. It includes physical, biogeochemical, and greenhouse gas (GHG) variables measured in surface seawater, such as temperature, salinity, dissolved oxygen, nutrients, chlorophyll-a, [...] Read more.
This dataset presents environmental observations collected in August 2021 from 18 port and harbor sites located around Jeju Island, Korea. It includes physical, biogeochemical, and greenhouse gas (GHG) variables measured in surface seawater, such as temperature, salinity, dissolved oxygen, nutrients, chlorophyll-a, pH, total alkalinity, and dissolved inorganic carbon. Concentrations and air–sea fluxes of nitrous oxide (N2O), methane (CH4), and carbon dioxide (CO2) were also quantified. All measurements were conducted following standardized analytical protocols, and certified reference materials and duplicate analyses were used to ensure data accuracy. Consequently, the dataset revealed that elevated nutrient accumulation in port and harbor waters and GHG concentrations tended to be higher at sites with stronger land-based influence. During August 2021, most sites functioned as sources of N2O, CH4, and CO2 to the atmosphere. This integrated dataset offers valuable insights into the influence of anthropogenic and hydrological factors on coastal GHG dynamics and provides a foundation for future studies across diverse semi-enclosed marine systems. Full article
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19 pages, 4055 KiB  
Article
Open-Ocean Carbonate System and Air–Sea CO2 Fluxes Across a NE Atlantic Seamount Complex (Madeira–Tore, August 2024)
by Marta Nogueira and Alexandra D. Silva
Oceans 2025, 6(3), 46; https://doi.org/10.3390/oceans6030046 - 17 Jul 2025
Viewed by 454
Abstract
This study focused on the carbonate system dynamics and air–sea CO2 fluxes in the open-ocean waters of the Madeira–Tore Seamount Complex during August 2024. Surface water properties revealed pronounced latitudinal gradients in sea surface temperature (21.9–23.1 °C), salinity (36.2–36.7), and dissolved oxygen [...] Read more.
This study focused on the carbonate system dynamics and air–sea CO2 fluxes in the open-ocean waters of the Madeira–Tore Seamount Complex during August 2024. Surface water properties revealed pronounced latitudinal gradients in sea surface temperature (21.9–23.1 °C), salinity (36.2–36.7), and dissolved oxygen (228–251 µmol Kg−1), influenced by mesoscale eddies and topographically driven upwelling. Despite oligotrophic conditions, distinct phytoplankton assemblages were observed, with coccolithophores dominating southern seamounts and open-ocean stations, and green algae and diatoms indicating episodic nutrient input. Surface total alkalinity (TA: 2236–2467 µmol Kg−1), dissolved inorganic carbon (DIC: 2006–2183 µmol Kg−1), and pCO2 (467–515 µatm) showed spatial variability aligned with water mass characteristics and biological activity. All stations exhibited positive air–sea CO2 fluxes (2.8–11.5 mmol m−2 d−1), indicating the region is a CO2 source during summer. Calcite and aragonite saturation states were highest in stratified, warmer waters. Principal Component Analysis highlighted the role of physical mixing, carbonate chemistry, and biological uptake in structuring regional variability. Our findings emphasize and contribute to the complex interplay of physical and biogeochemical drivers in modulating carbon cycling and ecosystem structure across Atlantic seamounts. Full article
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18 pages, 1790 KiB  
Article
Development of Co-Amorphous Systems for Inhalation Therapy—Part 1: From Model Prediction to Clinical Success
by Eleonore Fröhlich, Aurora Bordoni, Nila Mohsenzada, Stefan Mitsche, Hartmuth Schröttner and Sarah Zellnitz-Neugebauer
Pharmaceutics 2025, 17(7), 922; https://doi.org/10.3390/pharmaceutics17070922 - 16 Jul 2025
Viewed by 369
Abstract
Background/Objectives: The integration of machine learning (ML) and artificial intelligence (AI) has revolutionized the pharmaceutical industry by improving drug discovery, development and manufacturing processes. Based on literature data, an ML model was developed by our group to predict the formation of binary [...] Read more.
Background/Objectives: The integration of machine learning (ML) and artificial intelligence (AI) has revolutionized the pharmaceutical industry by improving drug discovery, development and manufacturing processes. Based on literature data, an ML model was developed by our group to predict the formation of binary co-amorphous systems (COAMSs) for inhalation therapy. The model’s ability to develop a dry powder formulation with the necessary properties for a predicted co-amorphous combination was evaluated. Methods: An extended experimental validation of the ML model by co-milling and X-ray diffraction analysis for 18 API-API (active pharmaceutical ingredient) combinations is presented. Additionally, one COAMS of rifampicin (RIF) and ethambutol (ETH), two first-line tuberculosis (TB) drugs are developed further for inhalation therapy. Results: The ML model has shown an accuracy of 79% in predicting suitable combinations for 35 APIs used in inhalation therapy; experimental accuracy was demonstrated to be 72%. The study confirmed the successful development of stable COAMSs of RIF-ETH either via spray-drying or co-milling. In particular, the milled COAMSs showed better aerosolization properties (higher ED and FPF with lower standard deviation). Further, RIF-ETH COAMSs show much more reproducible results in terms of drug quantity dissolved over time. Conclusions: ML has been shown to be a suitable tool to predict COAMSs that can be developed for TB treatment by inhalation to save time and cost during the experimental screening phase. Full article
(This article belongs to the Special Issue New Platform for Tuberculosis Treatment)
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16 pages, 2652 KiB  
Article
Evaluation of the Effect of Floating Treatment Wetlands Planted with Sesuvium portulacastrum on the Dynamics of Dissolved Inorganic Nitrogen, CO2, and N2O in Grouper Aquaculture Systems
by Shenghua Zheng, Man Wu, Jian Liu, Wangwang Ye, Yongqing Lin, Miaofeng Yang, Huidong Zheng, Fang Yang, Donglian Luo and Liyang Zhan
J. Mar. Sci. Eng. 2025, 13(7), 1342; https://doi.org/10.3390/jmse13071342 - 14 Jul 2025
Viewed by 243
Abstract
Aquaculture expansion to meet global protein demand has intensified concerns over nutrient pollution and greenhouse gas (GHG) emissions. While floating treatment wetlands (FTWs) are proven for water quality improvement, their potential to mitigate GHG emissions in marine aquaculture remains poorly understood. This study [...] Read more.
Aquaculture expansion to meet global protein demand has intensified concerns over nutrient pollution and greenhouse gas (GHG) emissions. While floating treatment wetlands (FTWs) are proven for water quality improvement, their potential to mitigate GHG emissions in marine aquaculture remains poorly understood. This study quantitatively evaluated the dual capacity of Sesuvium portulacastrum FTWs to (a) regulate dissolved inorganic nitrogen (DIN) and (b) reduce CO2/N2O emissions in grouper aquaculture systems. DIN speciation (NH4+, NO2, NO3) and CO2/N2O fluxes of six controlled ponds (three FTW and three control) were monitored for 44 days. DIN in the FTW group was approximately 90 μmol/L lower than that in the control group, and the water in the plant group was more “oxidative” than that in the control group. The former groups were dominated by NO3, with lower dissolved inorganic carbon (DIC) and N2O concentrations, whereas the latter were dominated by NH4+ during the first 20 days of the experiment and by NO2 at the end of the experiment, with higher DIC and N2O concentrations on average. Higher primary production may be the reason that the DIC concentration was lower in the plant group than in the control group, whereas efficient nitrification and uptake by plants reduced the availability of NH4+ in the plant group, thereby reducing the production of N2O. A comparison of the CO2 and N2O flux potentials in the plant group and control group revealed that, in the presence of FTWs, the CO2 and N2O emissions decreased by 14% and 36%, respectively. This showed that S. portulacastrum FTWs effectively couple DIN removal with GHG mitigation, offering a nature-based solution for sustainable aquaculture. Their low biomass requirement enhances practical scalability. Full article
(This article belongs to the Special Issue Coastal Geochemistry: The Processes of Water–Sediment Interaction)
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11 pages, 2969 KiB  
Article
First-Principles Study of CO, C2H2, and C2H4 Adsorption on Penta-Graphene for Transformer Oil Gas Sensing Applications
by Min-Qi Zhu and Xue-Feng Wang
C 2025, 11(3), 49; https://doi.org/10.3390/c11030049 - 9 Jul 2025
Viewed by 341
Abstract
Penta-graphene, a novel two-dimensional carbon allotrope entirely composed of pentagonal carbon rings, has attracted increasing attention due to its unique geometric structure, mechanical robustness, and intrinsic semiconducting nature. In this study, we systematically investigate the adsorption behavior of three typical dissolved gases in [...] Read more.
Penta-graphene, a novel two-dimensional carbon allotrope entirely composed of pentagonal carbon rings, has attracted increasing attention due to its unique geometric structure, mechanical robustness, and intrinsic semiconducting nature. In this study, we systematically investigate the adsorption behavior of three typical dissolved gases in transformer oil (CO, C2H2, and C2H4) on penta-graphene using first-principles calculations based on density functional theory. The optimized adsorption configuration, adsorption energy, charge transfer, adsorption distance, band structure, density of states, charge density difference, and desorption time are analyzed to evaluate the sensing capability of penta-graphene. Results reveal that penta-graphene exhibits moderate chemical interactions with CO and C2H2, accompanied by noticeable charge transfer and band structure changes, whereas C2H4 shows weaker physisorption characteristics. The projected density of states analysis further confirms the orbital hybridization between gas molecules and the substrate. Additionally, the desorption time calculations suggest that penta-graphene possesses good sensing and recovery potential, especially under elevated temperatures. These findings indicate that penta-graphene is a promising candidate for use in gas sensing applications related to the monitoring of dissolved gases in transformer oils. Full article
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