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Keywords = charge transfer processes

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38 pages, 4290 KiB  
Review
Carbon/High-Entropy Alloy Nanocomposites: Synergistic Innovations and Breakthrough Challenges for Electrochemical Energy Storage
by Li Sun, Hangyu Li, Yu Dong, Wan Rong, Na Zhou, Rui Dang, Jianle Xu, Qigao Cao and Chunxu Pan
Batteries 2025, 11(9), 317; https://doi.org/10.3390/batteries11090317 (registering DOI) - 23 Aug 2025
Abstract
Against the backdrop of accelerating global energy transition, developing high-performance energy-storage systems is crucial for achieving carbon neutrality. Traditional electrode materials are limited by a single densification storage mechanism and low conductivity, struggling to meet demands for high energy/power density and a long [...] Read more.
Against the backdrop of accelerating global energy transition, developing high-performance energy-storage systems is crucial for achieving carbon neutrality. Traditional electrode materials are limited by a single densification storage mechanism and low conductivity, struggling to meet demands for high energy/power density and a long cycle life. Carbon/high-entropy alloy nanocomposites provide an innovative solution through multi-component synergistic effects and cross-scale structural design: the “cocktail effect” of high-entropy alloys confers excellent redox activity and structural stability, while the three-dimensional conductive network of the carbon skeleton enhances charge transfer efficiency. Together, they achieve synergistic enhancement via interfacial electron coupling, stress buffering, and dual storage mechanisms. This review systematically analyzes the charge storage/attenuation mechanisms and performance advantages of this composite material in diverse energy-storage devices (lithium-ion batteries, lithium-sulfur batteries, etc.), evaluates the characteristics and limitations of preparation techniques such as mechanical alloying and chemical vapor deposition, identifies five major challenges (including complex and costly synthesis, ambiguous interfacial interaction mechanisms, lagging theoretical research, performance-cost trade-offs, and slow industrialization processes), and prospectively proposes eight research directions (including multi-scale structural regulation and sustainable preparation technologies, etc.). Through interdisciplinary perspectives, this review aims to provide a theoretical foundation for deepening the understanding of carbon/high-entropy alloy composite energy-storage mechanisms and guiding industrial applications, thereby advancing breakthroughs in electrochemical energy-storage technology under the energy transition. Full article
22 pages, 6742 KiB  
Article
Multiscale Evaluation of an Electrically Heated Thermal Battery for High-Temperature Industrial Energy Storage
by Munevver Elif Asar, Daniel McKinley, Bao Truong, Joey Kabel and Daniel Stack
Energies 2025, 18(17), 4461; https://doi.org/10.3390/en18174461 - 22 Aug 2025
Abstract
Industrial processes such as cement, steel, and glass manufacturing rely heavily on fossil fuels for high-temperature heat, presenting a significant challenge for decarbonization. To enable continuous thermal output from intermittent renewable electricity, Electrified Thermal Solutions, Inc. is developing the Joule Hive™ Thermal Battery [...] Read more.
Industrial processes such as cement, steel, and glass manufacturing rely heavily on fossil fuels for high-temperature heat, presenting a significant challenge for decarbonization. To enable continuous thermal output from intermittent renewable electricity, Electrified Thermal Solutions, Inc. is developing the Joule Hive™ Thermal Battery (JHTB), an electrically heated energy storage system capable of delivering process heat up to 1800 °C. The system employs electrically conductive firebricks (E-Bricks) as both heating elements and thermal storage media, arranged with insulating bricks (I-Bricks) to facilitate gas flow and heat exchange. The work combines experimental and numerical studies to evaluate the thermal, electrical, and structural performance of the JHTB. A small-scale charging experiment was conducted on a single E-Brick circuit in a 1500 °C furnace, showing good agreement with coupled thermal-electric finite element models that account for Joule heating, temperature-dependent properties, radiation, and natural convection. Structural modeling assessed stress induced by thermal gradients. In addition, a high-fidelity conjugate heat transfer model of the full JHTB core was developed to assess system-scale discharge performance, solving conservation equations with SST k-ω turbulence and radiation models. Simulations for two air channel geometries demonstrated the battery’s ability to deliver 5 MW of heat for at least five hours with air temperatures higher than 1000 °C, validating its potential for industrial decarbonization. Full article
(This article belongs to the Special Issue Highly Efficient Thermal Energy Storage (TES) Technologies)
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14 pages, 2928 KiB  
Article
Gold Nanoparticles-Functionalized Ultrathin Graphitic Carbon Nitride Nanosheets for Boosting Solar Hydrogen Production: The Role of Plasmon-Induced Interfacial Electric Fields
by Haidong Yu, Ziqi Wei, Qiyue Gao, Ping Qu, Rui Wang, Xuehui Luo, Xiao Sun, Dong Li, Xiao Zhang, Jiufen Liu and Liang Feng
Molecules 2025, 30(16), 3406; https://doi.org/10.3390/molecules30163406 - 18 Aug 2025
Viewed by 262
Abstract
The design of photocatalysts capable of generating localized surface plasmon resonance (LSPR) effects represents a promising strategy for enhancing photocatalytic activity. However, the mechanistic role of plasmonic nanoparticles-induced interfacial electric fields in driving photocatalytic processes remains poorly understood. To produce a Schottky junction, [...] Read more.
The design of photocatalysts capable of generating localized surface plasmon resonance (LSPR) effects represents a promising strategy for enhancing photocatalytic activity. However, the mechanistic role of plasmonic nanoparticles-induced interfacial electric fields in driving photocatalytic processes remains poorly understood. To produce a Schottky junction, varying amounts of Au nanoparticles widely utilized to broaden the light absorption were loaded onto ultrathin carbon nitride sheets (Au/UCN). The Au/UCN-20 Schottky junction exhibits exceptional photocatalytic activity, achieving a hydrogen evolution rate (14.2 mmol·g−1 over a 4 h period) while maintaining robust stability through five consecutive photocatalytic cycles. The LSPR activity of Au nanoparticles are responsible for the broadened light absorption spectrum of Au/UCN nanocomposites. The interfacial electric field generated at the Au /UCN heterojunction is proposed to enhance charge-transfer efficiency through Schottky barrier penetration of photocarriers, mediated by electric field-driven carrier migration, according to surface potential and finite-difference time-domain (FDTD). These findings uncover a previously obscured photocatalytic mechanism driven by LSPR-induced interfacial electric fields, pioneering a quantum-dot-directed strategy to precisely engineer charge dynamics in advanced photocatalysts via targeted manipulation of nanoscale electric field effects. Full article
(This article belongs to the Special Issue Green Catalysis Technology for Sustainable Energy Conversion)
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21 pages, 3124 KiB  
Article
Systematic Characterization of Lithium-Ion Cells for Electric Mobility and Grid Storage: A Case Study on Samsung INR21700-50G
by Saroj Paudel, Jiangfeng Zhang, Beshah Ayalew and Rajendra Singh
Batteries 2025, 11(8), 313; https://doi.org/10.3390/batteries11080313 - 16 Aug 2025
Viewed by 215
Abstract
Accurate parametric modeling of lithium-ion batteries is essential for battery management system (BMS) design in electric vehicles and broader energy storage applications, enabling reliable state estimation and effective thermal control under diverse operating conditions. This study presents a detailed characterization of lithium-ion cells [...] Read more.
Accurate parametric modeling of lithium-ion batteries is essential for battery management system (BMS) design in electric vehicles and broader energy storage applications, enabling reliable state estimation and effective thermal control under diverse operating conditions. This study presents a detailed characterization of lithium-ion cells to support advanced BMS in electric vehicles and stationary storage. A second-order equivalent circuit model is developed to capture instantaneous and dynamic voltage behavior, with parameters extracted through Hybrid Pulse Power Characterization over a broad range of temperatures (−10 °C to 45 °C) and state-of-charge levels. The method includes multi-duration pulse testing and separates ohmic and transient responses using two resistor–capacitor branches, with parameters tied to physical processes like charge transfer and diffusion. A weakly coupled electro-thermal model is presented to support real-time BMS applications, enabling accurate voltage, temperature, and heat generation prediction. This study also evaluates open-circuit voltage and direct current internal resistance across pulse durations, leading to power capability maps (“fish charts”) that capture discharge and regenerative performance across SOC and temperature. The analysis highlights performance asymmetries between charging and discharging and confirms model accuracy through curve fitting across test conditions. These contributions enhance model realism, thermal control, and power estimation for real-world lithium-ion battery applications. Full article
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17 pages, 5642 KiB  
Article
Influence of Fin Geometry on Enhancement of Phase Change Material Melting in a Finned Double-Pipe Heat Exchanger
by Amr Owes Elsayed
Energies 2025, 18(16), 4355; https://doi.org/10.3390/en18164355 - 15 Aug 2025
Viewed by 254
Abstract
Low thermal conductivity of phase change materials (PCMs) remains a major limitation in the design of efficient thermal energy storage systems. Enhancing the thermal performance of PCM storage units is therefore a critical design consideration. Fin geometry plays a pivotal role in improving [...] Read more.
Low thermal conductivity of phase change materials (PCMs) remains a major limitation in the design of efficient thermal energy storage systems. Enhancing the thermal performance of PCM storage units is therefore a critical design consideration. Fin geometry plays a pivotal role in improving the heat charging and discharging rates by influencing heat transfer mechanisms, particularly natural convection during melting. This study presents a two-dimensional numerical investigation of novel fin geometries aimed at accelerating the melting process of PCM in a double-pipe heat exchanger. Four fin designs are examined: single-step thickness reduction, double-step thickness reduction, stepwise thickness reduction/expansion, and smooth thickness reduction fins. These configurations are specifically developed to promote natural convection currents in the molten PCM regions adjacent to the fin’s surfaces. The enthalpy–porosity method is employed using ANSYS Fluent 19 to simulate the phase change process. The COUPLED algorithm is used for pressure–velocity coupling, with the PRESTO! scheme applied for pressure interpolation and a second-order upwind scheme adopted for the discretization of transport equations. The results demonstrate that the proposed thickness reduction fins significantly enhance the PCM melting rate by intensifying natural convection currents, driven by localized temperature gradients along the fin surfaces. Full article
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20 pages, 10780 KiB  
Article
Enhanced Photo-Fenton Removal of Oxytetracycline Hydrochloride via BP/Bi2MoO6 Z-Scheme Heterojunction Photocatalyst
by Jian Feng, Xiaohui Li, Xia Ran, Li Wang, Bo Xiao, Rong Li and Guangwei Feng
Int. J. Mol. Sci. 2025, 26(16), 7751; https://doi.org/10.3390/ijms26167751 - 11 Aug 2025
Viewed by 269
Abstract
Fenton oxidation technology utilizing hydrogen peroxide is recognized as an effective method for producing reactive oxygen species (ROS) to facilitate the degradation of antibiotics. However, the requirement for strongly acidic conditions during this process significantly restricts its broader applicability. In this study, we [...] Read more.
Fenton oxidation technology utilizing hydrogen peroxide is recognized as an effective method for producing reactive oxygen species (ROS) to facilitate the degradation of antibiotics. However, the requirement for strongly acidic conditions during this process significantly restricts its broader applicability. In this study, we synthesized black phosphorus (BP) nanosheets by exposing the {010} crystal planes and then constructed a 0D/2D BP/Bi2MoO6 (PBMO) heterojunction to function as a Fenton catalyst. The PBMO-75 heterojunction exhibited a remarkable increase in photo-Fenton catalytic activity towards oxytetracycline (OTC) under neutral conditions, achieving catalytic efficiencies that were 20 and 8 times greater than those of BP and Bi2MoO6 (BMO), respectively. This can be attributed to its strong absorption of visible light, the establishment of an internal electric field (IEF) at the interface, and the implementation of a Z-scheme catalytic mechanism. Additionally, the photo-Fenton system was further improved in OTC degradation through the continuous conversion of Mo6+/Mo5+ under visible light irradiation in conjunction with H2O2. Based on ERS, XPS, and active species trapping experiments, we propose a Z-scheme charge transfer mechanism for PBMO. This research offers compelling evidence that 0D/2D Z-scheme heterojunctions are promising candidates for the photo-Fenton treatment of antibiotic contaminants. Full article
(This article belongs to the Special Issue Latest Research in Photocatalysis)
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16 pages, 5434 KiB  
Article
Facile Engineering of CoS@NiS Heterostructures for Efficient Oxygen Evolution Reaction
by Ting Yang, Aiyi Dong, Weimin Liao, Xun Zhang, Yinhua Ma, Li Che and Honglin Gao
Nanomaterials 2025, 15(16), 1216; https://doi.org/10.3390/nano15161216 - 8 Aug 2025
Viewed by 308
Abstract
Hydrogen production by the electrolysis of water has become an important way to prepare green hydrogen because of its simple process and high product purity. However, the oxygen evolution reaction (OER) in the electrolysis process has a high overpotential, which leads to the [...] Read more.
Hydrogen production by the electrolysis of water has become an important way to prepare green hydrogen because of its simple process and high product purity. However, the oxygen evolution reaction (OER) in the electrolysis process has a high overpotential, which leads to the increase of energy consumption. Developing efficient, stable and low-cost electrolytic water catalyst is the core challenge to reduce the reaction energy barrier and improve the energy conversion efficiency. CoS@NiS-80% nanosheets with rich heterogeneous interfaces were successfully synthesized by hydrothermal reaction and sulfuration. Heterogeneous interface not only promotes the effective charge transfer between different materials and reduces the charge transfer resistance but also accelerates the four-electron transfer process through the synergistic effect of nickel and cobalt atoms. Under alkaline conditions, the overpotential of CoS@NiS-80% nanosheets was only 280 mV at a current density of 10 mA cm−2, with a Tafel slope of 100.87 mV dec−1. Furthermore, it could work continuously for 100 h, exhibiting its outstanding stability. This work provides a novel approach for improving the OER performance of transition metal sulfide-based electrocatalysts through heterogeneous interface engineering. Full article
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29 pages, 1494 KiB  
Article
Advanced and Robust Numerical Framework for Transient Electrohydrodynamic Discharges in Gas Insulation Systems
by Philipp Huber, Julian Hanusrichter, Paul Freden and Frank Jenau
Eng 2025, 6(8), 194; https://doi.org/10.3390/eng6080194 - 6 Aug 2025
Viewed by 257
Abstract
For the precise description of gas physical processes in high-voltage direct current (HVDC) transmission, an advanced and robust numerical framework for the simulation of transient particle densities in the course of corona discharges is developed in this work. The aim is the scalable [...] Read more.
For the precise description of gas physical processes in high-voltage direct current (HVDC) transmission, an advanced and robust numerical framework for the simulation of transient particle densities in the course of corona discharges is developed in this work. The aim is the scalable and consistent modeling of the space charge density under realistic conditions. The core component of the framework is a discontinuous Galerkin method that ensures the conservative properties of the underlying hyperbolic problem. The space charge density at the electrode surface is imposed as a dynamic boundary condition via Lagrange multipliers. To increase the numerical stability and convergence rate, a homotopy approach is also integrated. For the experimental validation, a measurement concept was realised that uses a subtraction method to specifically remove the displacement current component in the signal and thus enables an isolated recording of the transient ion current with superimposed voltage stresses. The experimental results on a small scale agree with the numerical predictions and prove the quality of the model. On this basis, the framework is transferred to hybrid HVDC overhead line systems with a bipolar design. In the event of a fault, significant transient space charge densities can be seen there, especially when superimposed with new types of voltage waveforms. The framework thus provides a reliable contribution to insulation coordination in complex HVDC systems and enables the realistic analysis of electrohydrodynamic coupling effects on an industrial scale. Full article
(This article belongs to the Section Electrical and Electronic Engineering)
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11 pages, 5112 KiB  
Article
Fabrication of a Porous TiNi3 Intermetallic Compound to Enhance Anti-Corrosion Performance in 1 M KOH
by Zhenli He, Yue Qiu, Yuehui He, Qian Zhao, Zhonghe Wang and Yao Jiang
Metals 2025, 15(8), 865; https://doi.org/10.3390/met15080865 - 1 Aug 2025
Viewed by 266
Abstract
Porous intermetallic compounds have the properties of porous materials as well as a combination of covalent and metallic bonds, and they exhibit high porosity, structural stability, and corrosion resistance. In this work, a porous TiNi3 intermetallic compound was fabricated through reactive synthesis [...] Read more.
Porous intermetallic compounds have the properties of porous materials as well as a combination of covalent and metallic bonds, and they exhibit high porosity, structural stability, and corrosion resistance. In this work, a porous TiNi3 intermetallic compound was fabricated through reactive synthesis of elemental powders. Next, detailed studies of its phase composition and pore structure characteristics at different sintering temperatures, as well as its corrosion behavior against an alkaline environment, were carried out. The results show that the as-prepared porous TiNi3 intermetallic compound has abundant pore structures, with an open porosity of 56.5%, which can be attributed to a combination of the bridging effects of initial powder particles and the Kirkendall effect occurring during the sintering process. In 1 M KOH solution, a higher positive corrosion potential (−0.979 VSCE) and a lower corrosion current density (1.18 × 10−4 A∙cm−2) were exhibited by the porous TiNi3 intermetallic compound, compared to the porous Ni, reducing the thermodynamic corrosion tendency and the corrosion rate. The corresponding corrosion process is controlled by the charge transfer process, and the increased charge transfer resistance value (713.9 Ω⋅cm2) of TiNi3 makes it more difficult to charge-transfer than porous Ni (204.5 Ω⋅cm2), thus decreasing the rate of electrode reaction. The formation of a more stable passive film with the incorporation of Ti contributes to this improved corrosion resistance performance. Full article
(This article belongs to the Special Issue Advanced Ti-Based Alloys and Ti-Based Materials)
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19 pages, 10949 KiB  
Article
Segmentation Control in Dynamic Wireless Charging for Electric Vehicles
by Tran Duc Hiep, Nguyen Huu Minh, Tran Trong Minh, Nguyen Thi Diep and Nguyen Kien Trung
Electronics 2025, 14(15), 3086; https://doi.org/10.3390/electronics14153086 - 1 Aug 2025
Viewed by 338
Abstract
Dynamic wireless charging systems have emerged as a promising solution to extend the driving range of electric vehicles by enabling energy transfer while the vehicle is in motion. However, the segment-based charging lane structure introduces challenges such as pulsation of the output power [...] Read more.
Dynamic wireless charging systems have emerged as a promising solution to extend the driving range of electric vehicles by enabling energy transfer while the vehicle is in motion. However, the segment-based charging lane structure introduces challenges such as pulsation of the output power and the need for precise switching control of the transmitting segments. This paper proposes a position-sensorless control method for managing transmitting lines in a dynamic wireless charging system. The proposed approach uses a segmented charging lane structure combined with two receiving coils and LCC compensation circuits on both the transmitting and receiving sides. Based on theoretical analysis, the study determines the optimal switching positions and signals to reduce the current fluctuation. To validate the proposed method, a dynamic wireless charging system prototype with a power rating of 3kW was designed, constructed, and tested in a laboratory environment. The results demonstrate that the proposed position-sensorless control method effectively mitigates power fluctuations and enhances the stability and efficiency of the wireless charging process. Full article
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25 pages, 7320 KiB  
Article
A Comprehensive Evaluation of a Chalcone Derivative: Structural, Spectroscopic, Computational, Electrochemical, and Pharmacological Perspectives
by Rekha K. Hebasur, Varsha V. Koppal, Deepak A. Yaraguppi, Neelamma B. Gummagol, Raviraj Kusanur and Ninganagouda R. Patil
Photochem 2025, 5(3), 20; https://doi.org/10.3390/photochem5030020 - 30 Jul 2025
Viewed by 368
Abstract
This study details how 3-(naphthalen-2-yl)-1-phenylprop-2-en-1-one (3NPEO) behaves in terms of photophysics when exposed to different solvents. The solvatochromic effect study reveals significant polarity shifts in the excited states of the 3NPEO compound, likely due to an intramolecular proton transfer mechanism. Measurements of dipole [...] Read more.
This study details how 3-(naphthalen-2-yl)-1-phenylprop-2-en-1-one (3NPEO) behaves in terms of photophysics when exposed to different solvents. The solvatochromic effect study reveals significant polarity shifts in the excited states of the 3NPEO compound, likely due to an intramolecular proton transfer mechanism. Measurements of dipole moments provide insight into their resonance structures in both ground and excited states. Electrochemical analysis revealed a reversible redox process, indicating a favorable charge transport potential. HOMO and LUMO energies of the compound were computed via oxidation and reduction potential standards. 3NPEO exhibits optimal one-photon and two-photon absorption characteristics, validating its suitability for visible wavelength laser applications in photonic devices. Furthermore, molecular docking and dynamics simulations demonstrated strong interactions between 3NPEO and the progesterone receptor enzyme, supported by structure–activity relationship (SAR) analyses. In vitro cytotoxicity assays on the MDAMB-231 breast cancer cell line showed moderate tumor cell inhibitory activity. Apoptosis studies confirmed the induction of both early and late apoptosis. These findings suggest that 3NPEO holds promise as a potential anticancer agent targeting the progesterone receptor in breast cancer cells. Overall, the findings highlight the substantial influence of solvent polarity on the photophysical properties and the design of more effective and stable therapeutic agents. Full article
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21 pages, 7973 KiB  
Article
Enhanced Response of ZnO Nanorod-Based Flexible MEAs for Recording Ischemia-Induced Neural Activity in Acute Brain Slices
by José Ignacio Del Río De Vicente, Valeria Marchetti, Ivano Lucarini, Elena Palmieri, Davide Polese, Luca Montaina, Francesco Maita, Jan Kriska, Jana Tureckova, Miroslava Anderova and Luca Maiolo
Nanomaterials 2025, 15(15), 1173; https://doi.org/10.3390/nano15151173 - 30 Jul 2025
Viewed by 469
Abstract
Brain ischemia is a severe condition caused by reduced cerebral blood flow, leading to the disruption of ion gradients in brain tissue. This imbalance triggers spreading depolarizations, which are waves of neuronal and glial depolarization propagating through the gray matter. Microelectrode arrays (MEAs) [...] Read more.
Brain ischemia is a severe condition caused by reduced cerebral blood flow, leading to the disruption of ion gradients in brain tissue. This imbalance triggers spreading depolarizations, which are waves of neuronal and glial depolarization propagating through the gray matter. Microelectrode arrays (MEAs) are essential for real-time monitoring of these electrophysiological processes both in vivo and in vitro, but their sensitivity and signal quality are critical for accurate detection of extracellular brain activity. In this study, we evaluate the performance of a flexible microelectrode array based on gold-coated zinc oxide nanorods (ZnO NRs), referred to as nano-fMEA, specifically for high-fidelity electrophysiological recording under pathological conditions. Acute mouse brain slices were tested under two ischemic models: oxygen–glucose deprivation (OGD) and hyperkalemia. The nano-fMEA demonstrated significant improvements in event detection rates and in capturing subtle fluctuations in neural signals compared to flat fMEAs. This enhanced performance is primarily attributed to an optimized electrode–tissue interface that reduces impedance and improves charge transfer. These features enabled the nano-fMEA to detect weak or transient electrophysiological events more effectively, making it a valuable platform for investigating neural dynamics during metabolic stress. Overall, the results underscore the promise of ZnO NRs in advancing electrophysiological tools for neuroscience research. Full article
(This article belongs to the Section Biology and Medicines)
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13 pages, 1132 KiB  
Review
M-Edge Spectroscopy of Transition Metals: Principles, Advances, and Applications
by Rishu Khurana and Cong Liu
Catalysts 2025, 15(8), 722; https://doi.org/10.3390/catal15080722 - 30 Jul 2025
Viewed by 501
Abstract
M-edge X-ray absorption spectroscopy (XAS), which probes 3p→3d transitions in first-row transition metals, provides detailed insights into oxidation states, spin-states, and local electronic structure with high element and orbital specificity. Operating in the extreme ultraviolet (XUV) region, this technique provides [...] Read more.
M-edge X-ray absorption spectroscopy (XAS), which probes 3p→3d transitions in first-row transition metals, provides detailed insights into oxidation states, spin-states, and local electronic structure with high element and orbital specificity. Operating in the extreme ultraviolet (XUV) region, this technique provides sharp multiplet-resolved features with high sensitivity to ligand field and covalency effects. Compared to K- and L-edge XAS, M-edge spectra exhibit significantly narrower full widths at half maximum (typically 0.3–0.5 eV versus >1 eV at the L-edge and >1.5–2 eV at the K-edge), owing to longer 3p core-hole lifetimes. M-edge measurements are also more surface-sensitive due to the lower photon energy range, making them particularly well-suited for probing thin films, interfaces, and surface-bound species. The advent of tabletop high-harmonic generation (HHG) sources has enabled femtosecond time-resolved M-edge measurements, allowing direct observation of ultrafast photoinduced processes such as charge transfer and spin crossover dynamics. This review presents an overview of the fundamental principles, experimental advances, and current theoretical approaches for interpreting M-edge spectra. We further discuss a range of applications in catalysis, materials science, and coordination chemistry, highlighting the technique’s growing impact and potential for future studies. Full article
(This article belongs to the Special Issue Spectroscopy in Modern Materials Science and Catalysis)
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20 pages, 11218 KiB  
Article
Solvatochromic and Computational Study of Three Benzo-[f]-Quinolinium Methylids with Photoinduced Charge Transfer
by Mihaela Iuliana Avadanei, Ovidiu Gabriel Avadanei and Dana Ortansa Dorohoi
Molecules 2025, 30(15), 3162; https://doi.org/10.3390/molecules30153162 - 29 Jul 2025
Viewed by 275
Abstract
The solvatochromic properties of 48 solvents of three benzo-[f]-quinolinium methylids (BfQs) were analyzed within the theories of the variational model and Abe’s model of the liquid. The electro-optical properties of BfQs in the first excited state were determined based on the charge transfer [...] Read more.
The solvatochromic properties of 48 solvents of three benzo-[f]-quinolinium methylids (BfQs) were analyzed within the theories of the variational model and Abe’s model of the liquid. The electro-optical properties of BfQs in the first excited state were determined based on the charge transfer process that occurs from the ylid carbon to the nitrogen atom. The dipole moments and the polarizabilities in the first excited state were calculated according to the two models. The quantum chemical calculations helped in understanding the relationship between the molecular structure and absorption properties of the ground state. It is concluded that several key parameters modulate the strength of the charge transfer and they work in synergy, and the most important are as follows: (i) isomerism around the single polar bond, and (ii) the properties of the solvent. The link between geometrical conformation and the zwitterionic character make the studied BfQs very sensitive chromophores for sensors and optical switching devices. Full article
(This article belongs to the Special Issue Feature Papers in Applied Chemistry: 4th Edition)
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20 pages, 3837 KiB  
Review
Recent Advances in the Application of VO2 for Electrochemical Energy Storage
by Yuxin He, Xinyu Gao, Jiaming Liu, Junxin Zhou, Jiayu Wang, Dan Li, Sha Zhao and Wei Feng
Nanomaterials 2025, 15(15), 1167; https://doi.org/10.3390/nano15151167 - 28 Jul 2025
Viewed by 326
Abstract
Energy storage technology is crucial for addressing the intermittency of renewable energy sources and plays a key role in power systems and electronic devices. In the field of energy storage systems, multivalent vanadium-based oxides have attracted widespread attention. Among these, vanadium dioxide (VO [...] Read more.
Energy storage technology is crucial for addressing the intermittency of renewable energy sources and plays a key role in power systems and electronic devices. In the field of energy storage systems, multivalent vanadium-based oxides have attracted widespread attention. Among these, vanadium dioxide (VO2) is distinguished by its key advantages, including high theoretical capacity, low cost, and strong structural designability. The diverse crystalline structures and plentiful natural reserves of VO2 offer a favorable foundation for facilitating charge transfer and regulating storage behavior during energy storage processes. This mini review provides an overview of the latest progress in VO2-based materials for energy storage applications, specifically highlighting their roles in lithium-ion batteries, zinc-ion batteries, photoassisted batteries, and supercapacitors. Particular attention is given to their electrochemical properties, structural integrity, and prospects for development. Additionally, it explores future development directions to offer theoretical insights and strategic guidance for ongoing research and industrial application of VO2. Full article
(This article belongs to the Special Issue Nanostructured Materials for Energy Storage)
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