Search Results (529)

The transition to green energy in the transport sector is becoming a priority in the context of global climate challenges and the European Green Deal. This paper investigates the development of alternative fuelling stations, particularly electric vehicle (EV) charging infrastructure and hydrogen stations, across EU countries with a focus on Poland. It combines a policy and technology overview with a quantitative scientific analysis, offering a multidimensional perspective on green infrastructure deployment. A Pearson correlation analysis reveals significant links between charging station density and both GDP per capita and the share of renewable energy. The study introduces an original Infrastructure Accessibility Index (IAI) to compare infrastructure availability across EU member states and models Poland’s EV charging station demand up to 2030 under multiple growth scenarios. Furthermore, the article provides a comprehensive overview of biofuels, including first-, second-, and third-generation technologies, and highlights recent advances in hydrogen and renewable electricity integration. Emphasis is placed on life cycle considerations, energy source sustainability, and economic implications. The findings support policy development toward zero-emission mobility and the decarbonisation of transport systems, offering recommendations for infrastructure expansion and energy diversification strategies. Full article

Hydrogen production is increasingly vital for global decarbonization but remains a water- and energy-intensive process, especially in arid regions. Despite growing attention to its climate benefits, limited research has addressed the environmental impacts of water sourcing. This study employs a life cycle assessment (LCA) approach to evaluate three water supply strategies for hydrogen production: (1) seawater desalination without brine treatment (BT), (2) desalination with partial BT, and (3) freshwater purification. Scenarios are modeled for the United Arab Emirates (UAE), Australia, and Spain, representing diverse electricity mixes and water stress conditions. Both electrolysis and steam methane reforming (SMR) are evaluated as hydrogen production methods. Results show that desalination scenarios contribute substantially to human health and ecosystem impacts due to high energy use and brine discharge. Although partial BT aims to reduce direct marine discharge impacts, its substantial energy demand can offset these benefits by increasing other environmental burdens, such as marine eutrophication, especially in regions reliant on carbon-intensive electricity grids. Freshwater scenarios offer lower environmental impact overall but raise water availability concerns. Across all regions, feedwater for SMR shows nearly 50% lower impacts than for electrolysis. This study focuses solely on the environmental impacts associated with water sourcing and treatment for hydrogen production, excluding the downstream impacts of the hydrogen generation process itself. This study highlights the trade-offs between water sourcing, brine treatment, and freshwater purification for hydrogen production, offering insights for optimizing sustainable hydrogen systems in water-stressed regions. Full article

This review surveys recent advances and emerging prospects in phase-transfer catalysis (PTC) for fuel desulfurization. In response to increasingly stringent environmental regulations, the removal of sulfur from transportation fuels has become imperative for curbing SO_x emissions. Conventional hydrodesulfurization (HDS) operates under severe temperature–pressure conditions and displays limited efficacy toward sterically hindered thiophenic compounds, motivating the exploration of non-hydrogen routes such as oxidative desulfurization (ODS). Within ODS, PTC offers distinctive benefits by shuttling reactants across immiscible phases, thereby enhancing reaction rates and selectivity. In particular, PTC enables efficient migration of organosulfur substrates from the hydrocarbon matrix into an aqueous phase where they are oxidized and subsequently extracted. The review first summarizes the deployment of classic PTC systems—quaternary ammonium salts, crown ethers, and related agents—in ODS operations and then delineates the underlying phase-transfer mechanisms, encompassing reaction-controlled, thermally triggered, photo-responsive, and pH-sensitive cycles. Attention is next directed to a new generation of catalysts, including quaternary-ammonium polyoxometalates, imidazolium-substituted polyoxometalates, and ionic-liquid-based hybrids. Their tailored architectures, catalytic performance, and mechanistic attributes are analyzed comprehensively. By incorporating multifunctional supports or rational structural modifications, these systems deliver superior desulfurization efficiency, product selectivity, and recyclability. Despite such progress, commercial deployment is hindered by the following outstanding issues: long-term catalyst durability, continuous-flow reactor design, and full life-cycle cost optimization. Future research should, therefore, focus on elucidating structure–performance relationships, translating batch protocols into robust continuous processes, and performing rigorous environmental and techno-economic assessments to accelerate the industrial adoption of PTC-enabled desulfurization. Full article

The large-scale integration of volatile and intermittent renewables necessitates greater flexibility in the power system. Improving this flexibility is key to achieving a high proportion of renewable energy consumption. In this context, the scientific selection of energy storage technology is of great significance for the construction of new power systems. From the perspective of life cycle cost analysis, this paper conducts an economic evaluation of four mainstream energy storage technologies: lithium iron phosphate battery, pumped storage, compressed air energy storage, and hydrogen energy storage, and quantifies and compares the life cycle cost of multiple energy storage technologies. On this basis, a three-dimensional multi-energy storage comprehensive evaluation indicator system covering economy, technology, and environment is constructed. The improved grade one method and entropy weight method are used to determine the comprehensive performance, and the fuzzy comprehensive evaluation method is used to carry out multi-attribute decision-making on the multi-energy storage technology in the source, network, and load scenarios. The results show that pumped storage and compressed air energy storage have significant economic advantages in long-term and large-scale application scenarios. With its fast response ability and excellent economic and technical characteristics, the lithium iron phosphate battery has the smallest score change rate (15.2%) in various scenarios, showing high adaptability. However, hydrogen energy storage technology still lacks economic and technological maturity, and breakthrough progress is still needed for its wide application in various application scenarios in the future. Full article

To address the limitations of conventional single-stack fuel cell hybrid systems using equivalent hydrogen consumption strategies, this study proposes a multi-stack energy management strategy incorporating fuel cell health degradation. Leveraging a fuel cell efficiency decay model and lithium-ion battery cycle life assessment, power distribution is reformulated as an equivalent hydrogen consumption optimization problem with stack degradation constraints. A hybrid Genetic Algorithm–Particle Swarm Optimization (GA-PSO) approach achieves global optimization. The experimental results demonstrate that compared with the Frequency Decoupling (FD) method, the GA-PSO strategy reduces hydrogen consumption by 7.03 g and operational costs by 4.78%; compared with the traditional Particle Swarm Optimization (PSO) algorithm, it reduces hydrogen consumption by 3.61 g per operational cycle and decreases operational costs by 2.66%. This strategy ensures stable operation of the marine power system while providing an economically viable solution for hybrid-powered vessels. Full article

Underground hydrogen storage (UHS) in geological formations offers a promising solution for large-scale energy buffering, but its long-term safety and mechanical stability remain concerns, particularly in fractured rock environments. This study develops a fully coupled thermo-mechanical model to investigate the cyclic response of a dual-cavern hydrogen storage system with polymer-based sealing layers. The model incorporates non-isothermal gas behavior, rock heterogeneity via a Weibull distribution, and fracture networks represented through stochastic geometry. Two operational scenarios, single-cavern and dual-cavern cycling, are simulated to evaluate stress evolution, displacement, and inter-cavity interaction under repeated pressurization. Results reveal that simultaneous operation of adjacent caverns amplifies tensile and compressive stress concentrations, especially in inter-cavity rock bridges (i.e., the intact rock zones separating adjacent caverns) and fracture-dense zones. Polymer sealing layers remain under compressive stress but exhibit increased residual deformation under cyclic loading. Contour analyses further show that fracture orientation and spatial distribution significantly influence stress redistribution and deformation localization. The findings highlight the importance of considering thermo-mechanical coupling and rock fracture mechanics in the design and operation of multicavity UHS systems. This modeling framework provides a robust tool for evaluating storage performance and informing safe deployment in complex geological environments. Full article

Given the adverse effects of organic dyes from aqueous solutions on human physiology and the ecological system, establishing an effective system for their elimination is imperative. This study employs the in situ thermal (IST) method to synthesize nanocomposites comprising zeolitic imidazole frameworks, specifically Fe-ZIF-8 and Fe-ZIF-67. The investigation offers a comprehensive evaluation of the properties of these nano-adsorbents for the removal of malachite green (MG). The results indicate a significantly increased adsorption capacity of up to 495 and 552 mg g⁻¹ for Fe-ZIF-8 and Fe-ZIF-67, respectively. Furthermore, they demonstrate removal efficiencies of up to 90% and 95% for MG, respectively. Parameters associated with the adsorption process are derived from isotherms and removal kinetics, specifically the Freundlich model and the pseudo-second-order kinetics model, respectively. The enhanced adsorption capacity observed in Fe-ZIF-8 and Fe-ZIF-67 can be attributed to π–π stacking interactions, hydrogen bonding, and electrostatic attraction. After undergoing three cycles, both adsorbents consistently exhibit a high removal efficiency of approximately 85%, indicating notable structural integrity and outstanding potential for repeated use. The examined adsorbents display exceptional efficacy, favorable stability, and substantial specific surface area, underscoring their remarkable adsorption capabilities. The nanocomposites comprising Fe-ZIF-8 and Fe-ZIF-67 demonstrate considerable potential as highly favorable options for the elimination of MG and other cationic organic dyes from aqueous environments. Full article

This article uses FLUENT to construct a two-dimensional axisymmetric numerical model of a cryogenic hydrogen charging pipeline. By loading with initial temperature gradient and transient initial pressure disturbance, the basic characteristics of low-temperature hydrogen Taconis thermoacoustic oscillation are calculated, including temperature, heat flux density distribution, pressure amplitude, and frequency. The instability boundary of hydrogen TAO is also obtained. The results show that (1) the temperature distribution and flow characteristics of the gas inside the pipeline exhibit significant periodic changes. In the first half of the oscillation period, the cold-end gas moves towards the end of the pipeline. Low-viscosity cold hydrogen is easily heated and rapidly expands. In the second half of the cycle, the expanding cold gas pushes the hot-end gas to move towards the cold end, forming a low-pressure zone and causing gas backflow. (2) Thermoacoustic oscillation can also cause additional thermal leakage on the pipeline wall. The average heat flux during one cycle is 1150.1 W/m² for inflow and 1087.7 W/m² for outflow, with a net inflow heat flux of 62.4 W/m². (3) The instability boundary of the system is mainly determined by the temperature ratio of the cold and hot ends α, temperature gradient β, and length ratio of the cold and hot ends ξ. Increasing the pipe diameter and minimizing the pipe length can effectively weaken the amplitude of thermoacoustic oscillations. This study provides theoretical support for predicting thermoacoustic oscillations in low-temperature hydrogen transport pipeline systems and offers insights for system stability control and design verification. Full article

The establishment of carbon capture, utilization, and storage supply chains at the national level is crucial for meeting global decarbonization targets: they have been suggested as a solution to maintain the global temperature rise below 2 °C relative to preindustrial levels. Optimizing these systems requires a balance of economic viability with environmental impact, but this is a challenge due to diverse operational limitations. This paper introduces an optimization framework that integrates life cycle assessment with a source-sink model while combining the geographical storage and conversion pathways of carbon dioxide into high-value chemicals. This study explores the economic and environmental outcomes of national carbon capture, utilization, and storage networks, considering several constraints, such as carbon dioxide reduction goals, product market demand, and renewable hydrogen availability. The framework is utilized in Germany as a case study, presenting three case studies to maximize overall annual profit and life cycle greenhouse gas reduction. In all analyzed scenarios, the results indicate a clear trade-off between profitability and emission reductions: profit-driven strategies are characterized by increased emissions, while environmental strategies have higher costs despite the environmental benefit. In addition, cost-optimal cases prefer high-profit utilization routes (e.g., gasoline through methane reforming) and cost-effective capture technologies, leading to significant profitability. On the other hand, climate-optimal approaches require diversification, integrating carbon dioxide storage with conversion pathways that exhibit lower emissions (e.g., gasoline, acetic acid, methanol through carbon dioxide hydrogenation). The proposed method significantly contributes to developing and constructing more sustainable, large-scale carbon projects. Full article

The contamination of aquatic systems by industrial dyes, particularly methylene blue (MB), presents a significant environmental challenge due to their chemical stability and toxicity. In this study, the development and application of a novel magnetic nanohybrid comprising multiwall carbon nanotubes (MWCNTs) functionalized with maghemite (γ-Fe₂O₃) nanoparticles biosynthesized using Eucalyptus globulus extract (denoted MWNT-NPE) is reported. The material was thoroughly characterized by X-ray diffraction (XRD), Brunauer–Emmett–Teller (BET), Vibrating Sample Magnetometer (VSM), and Fourier-Transform Infrared (FTIR) techniques, revealing high crystallinity, mesoporosity, and superparamagnetic behavior. The MWNT-NPE exhibited exceptional MB adsorption performance under optimized conditions (pH 6, 0.8 g L⁻¹ dose, 40 min equilibrium), achieving a maximum adsorption capacity of 92.9 mg g⁻¹. Kinetic analysis indicated chemisorption and physisorption regimes depending on MB concentration, with the pseudo-second-order and Freundlich isotherm models providing the best fits of experimental data. FTIR spectroscopy demonstrated that the removal mechanism involves π–π stacking, hydrogen bonding, and electrostatic interactions between MB molecules and the composite’s surface functional groups. Notably, the magnetic nanohybrid retained over 98% removal efficiency across five regeneration cycles and successfully removed MB from synthetic effluents with efficiencies exceeding 91%. These findings highlight the synergistic adsorption and magnetic recovery capabilities of the bio-functionalized hybrid system, presenting a sustainable, reusable, and scalable solution for industrial dye remediation. Full article

Hydrogen–gasoline dual-fuel spark ignition (SI) engines represent a promising transitional solution toward cleaner combustion and reduced carbon emissions. In a previous study, a predictive engine model was developed to simulate the performance and combustion characteristics of such systems; however, its accuracy was constrained by the use of estimated combustion parameters. This study presents an experimental validation based on high-resolution in-cylinder pressure measurements performed on a naturally aspirated SI engine operating with a 20% hydrogen energy share. The objectives are twofold: (1) to refine the combustion model using empirically derived combustion metrics, and (2) to evaluate the feasibility of moderate hydrogen enrichment in a stock engine configuration. To facilitate a more accurate understanding of how key combustion parameters evolve under different operating conditions, Vibe function was fitted to the ensemble-averaged heat release rate curves computed from 100 consecutive engine cycles at each static full-load operating point. This approach enabled the extraction of stable and representative metrics, including the mass fraction burned at 50% (MFB50) and combustion duration, which were then used to recalibrate the predictive combustion model. In addition, cycle-to-cycle variation and combustion duration were also investigated in the dual-fuel mode. The combustion duration exhibited a consistent and substantial reduction across all of the examined operating points when compared to pure gasoline operation. Furthermore, the cycle-to-cycle variation difference remained statistically insignificant, indicating that the introduction of 20% hydrogen did not adversely affect combustion stability. In addition to improving model accuracy, this work investigates the occurrence of abnormal combustion phenomena—including backfiring, auto-ignition, and knock—under enriched conditions. The results confirm that 20% hydrogen blends can be safely utilized in standard engine architectures, yielding faster combustion and reduced burn durations. The validated model offers a reliable foundation for further dual-fuel optimization and supports the broader integration of hydrogen into conventional internal combustion platforms. Full article

Sleep disorders, such as insomnia and narcolepsy, significantly impact quality of life. They are often associated with long-term health consequences, including cardiovascular disease, immune dysfunction, and cognitive impairment. While traditional treatments, such as sedatives and hypnotics, can be effective, they are limited by issues of tolerance and dependence. The orexinergic system, particularly the orexin 1 receptor (OXR1), has emerged as a promising therapeutic target due to its central role in regulating sleep–wake cycles. In this study, we investigate the molecular interactions of three OXR1 antagonists—daridorexant, lemborexant, and suvorexant—using an integrated computational approach combining molecular dynamics (MD) simulations, density functional theory (DFT) calculations, and the molecular fractionation with conjugate caps (MFCC) methodology. The MFCC approach enabled the precise quantification of interaction energies between ligands and key receptor residues, providing detailed insights into the contributions of specific amino acids to binding stability. Our results reveal that residues such as GLU204, HIS216, and ASN318 play critical roles in stabilizing ligand–receptor interactions, with a marked decrease in binding energy magnitude as dielectric constants increase. Daridorexant exhibited the strongest interaction energy, driven by hydrogen bonds and hydrophobic contacts, while lemborexant and suvorexant showed distinct stabilization patterns mediated by hydrophobic interactions. These findings provide a robust molecular basis for the rational design of next-generation OXR1 antagonists with improved efficacy and safety profiles. By elucidating drug–receptor interactions at the atomic level, this research underscores the impact of integrated computational approaches in drug discovery. It supports the development of precise targeted therapies for sleep disorders. Full article

Bio-based ionic conductive hydrogels have attracted significant attention for use in wearable electronic sensors due to their inherent flexibility, ionic conductivity, and biocompatibility. However, achieving a balance between high ionic conductivity and mechanical robustness remains a significant challenge. In this study, we present a simple yet effective strategy for fabricating a polyelectrolyte–chitin double-network hydrogel (CAA) via the copolymerization of acrylamide (AM) and acrylic acid (AA) with chitin in an AlCl₃-ZnCl₂-H₂O ternary molten salt system. The synergistic interactions of dynamic metal ion coordination bonds and hydrogen bonding impart the CAA hydrogel with outstanding mechanical properties, including a fracture strain of 1765.5% and a toughness of 494.4 kJ/m³, alongside a high ionic conductivity of 1.557 S/m. Moreover, the hydrogel exhibits excellent thermal stability across a wide temperature range (−50 °C to 25 °C). When employed as a wearable sensor, the hydrogel demonstrates a rapid response time (<0.2 s), remarkable durability over 95 cycles with less than 5% resistance drift, and high sensitivity in detecting various human joint motions (e.g., finger, knee, and elbow bending). It presents a scalable strategy for biomass-derived flexible electronics that harmonizes mechanical robustness with electromechanical performance. Full article

Sotolon is a chiral furanone derivative featuring three distinct oxygen atoms at carbonyl, hydroxyl, and cyclic ether groups that can serve as hydrogen-bond acceptor sites, making it an ideal model system for probing water’s preferential interactions with competing functional groups. In this study, the rotational spectrum of sotolon and its microsolvated complexes, representing the early stages of hydration, was investigated using chirped-pulse Fourier transform microwave (CP-FTMW) spectroscopy. The conformational landscape of sotolon is dominated by a single conformer stabilized by an intramolecular O–H···O=C hydrogen bond. During hydration, water molecules disrupt this interaction by forming closed hydrogen-bonded cycles, resulting in mono- and dihydrated complexes. High-level theoretical calculations underscore the central role of electrostatic interactions in stabilizing these hydrated structures. Furthermore, A/E splittings observed in the rotational spectrum, arising from the internal rotation of one of sotolon’s methyl groups, provide insight into how hydration modulates the methyl internal rotation barrier. Full article

This paper presents a systematic analysis of the solid products formed during the cathodic decomposition of chalcopyrite using the acetic acid system. The reduction of chalcopyrite was assessed using different electrochemical and surface characterization techniques. The effect of multiple cathodic polarizations of chalcopyrite immersed in acetic acid was evaluated on the formation of less refractory copper species through the interaction of chalcopyrite with monoatomic hydrogen. The reduction products obtained were characterized by the FESEM/EDS techniques. The results revealed that the iron content in the chalcopyrite lattice was continuously decreased and released into the acetic acid solution when the polarization cycles were increased from 1 to 11 starting from OCP to −2.2 V vs. SHE. The chemical analyses revealed that iron released into the solution corresponds to 0.085 and 1.95 mg/L for 1 and 11 cycles, respectively. The open circuit potential (OCP) measurements of the solid products were shifted to more cathodic potentials than that of chalcopyrite, confirming the possibility to form less refractory species in this weak organic acid. Finally, the FESEM-EDS and XRD analyses showed that chalcopyrite refractoriness decreased, producing Cu, Cu₂S, CuS, CuO, and C₄H₆CuO₄H₂O species depending on the applied energetic condition. Full article