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2D-layered Sn/Ge anodes for lithium-ion batteries with high capacity and ultra-fast Li ion diffusivity 被引量:2
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作者 Xiyu Cao Yanchen Fan +3 位作者 Jiale Qu Tianshuai Wang Dominik Legut Qianfan Zhang 《Journal of Energy Chemistry》 SCIE EI CAS CSCD 2020年第8期160-165,I0006,共7页
As a new type of green energy, lithium-ion battery(LIB) has been widely used in various electric portable devices because of its high-voltage, large specific capacity, long cycle life and environmental friendliness [1... As a new type of green energy, lithium-ion battery(LIB) has been widely used in various electric portable devices because of its high-voltage, large specific capacity, long cycle life and environmental friendliness [1,2]. However, today’s anode materials of commercial LIBs cannot meet the further development requirements of smart devices and electric car due to the limitations of the electrode capacity(e.g. 372 mAh g-1 for graphite). 展开更多
关键词 2D-layered material Stanene Germanene lithium-ion battery Lithium diffusion
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Estimation of Chloride Diffusivity in Hydrated Tricalcium Silicate Using a Hydration-Diffusion Integrated Method
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作者 WANG Xin SHEN Dejian +2 位作者 TAO Sijie LIU Ruixin WU Shengxing 《Journal of Wuhan University of Technology(Materials Science)》 SCIE EI CAS 2025年第1期49-64,共16页
This study aims to develop a chloride diffusion simulation method that considers the hydration microstructure and pore solution properties during the hydration of tricalcium silicate(C3S).The method combines the hydra... This study aims to develop a chloride diffusion simulation method that considers the hydration microstructure and pore solution properties during the hydration of tricalcium silicate(C3S).The method combines the hydration simulation,thermodynamic calculation,and finite element analysis to examine the effects of pore solution,including effect of electrochemical potential,effect of chemical activity,and effect of mechanical interactions between ions,on the chloride effective diffusion coefficient of hydrated C3S paste.The results indicate that the effect of electrochemical potential on chloride diffusion becomes stronger with increasing hydration age due to the increase in the content of hydrated calcium silicate;as the hydration age increases,the effect of chemical activity on chloride diffusion weakens when the number of diffusible elements decreases;the effect of mechanical interactions between ions on chloride diffusion decreases with the increase of hydration age. 展开更多
关键词 tricalcium silicate simulation method chloride diffusion coefficient pore solution
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Lithium Diffusion-Efficient Ionogels as Polymer Solid Electrolyte for Next-Gen Lithium-Ion Batteries
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作者 Boluwatife Igbaroola Yassine Eddahani +4 位作者 Patrick Howlett Maria Forsyth Luke O’Dell Nicolas Dupré Jean Le Bideau 《Energy & Environmental Materials》 2025年第1期106-112,共7页
The search for safer next-generation lithium-ion batteries(LIBs)has driven significant research on non-toxic,non-flammable solid electrolytes.However,their electrochemical performance often falls short.This work prese... The search for safer next-generation lithium-ion batteries(LIBs)has driven significant research on non-toxic,non-flammable solid electrolytes.However,their electrochemical performance often falls short.This work presents a simple,one-step photopolymerization process for synthesizing biphasic liquid–solid ionogel electrolytes using acrylic acid monomer and P_(111i4)FSI ionic liquid.We investigated the impact of lithium salt concentration and temperature on ion diffusion,particularly lithium-ion(Li^(+))mobility,within these ionogels.Pulsed-field gradient nuclear magnetic resonance(PFG-NMR)revealed enhanced Li^(+)diffusion in the acrylic acid(AA)-based ionogels compared to their non-confined ionic liquid counterparts.Remarkably,Li^(+)diffusion remained favorable in the ionogels regardless of salt concentration.These AA-based ionogels demonstrate very good ionic conductivity(>1 mS cm^(-1) at room temperature)and a wide electrochemical window(up to 5.3 V vs Li^(+)/Li^(0)).These findings suggest significant promise for AA-based ionogels as polymer solid electrolytes in future solid-state battery applications. 展开更多
关键词 diffusION ionic liquid electrolytes ionogel lithium-ion batteries solid-state batteries
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Impact of Surface Microstructures on Diffusion-Induced Stress in Lithium-Ion Battery Electrodes:A Mechanical-Chemical Coupling Study
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作者 Shuo Zhao Jindong Hao +4 位作者 Liuli Zhang Hai Liu Liyang Lin Cuihua An Qibo Deng 《Acta Mechanica Solida Sinica》 2025年第3期500-507,共8页
The Lithium-ion deintercalation induces a significant volume change in battery electrodes during charging and discharging processes,which in turn generates a large diffusion-induced stress(DIS).This stress can cause m... The Lithium-ion deintercalation induces a significant volume change in battery electrodes during charging and discharging processes,which in turn generates a large diffusion-induced stress(DIS).This stress can cause microstructural damage,consequently degrading battery performance.This work simplifies the particles making up the electrode into spheres and studies the impact of the surface microstructure on the distribution of diffusion-induced stress.A mechanical-chemical coupling model was established to study the DIS in secondary particles,which were constructed by adding convex particles to the ball-shaped particle surfaces of the electrode material.It is observed that an increase in the number of convex particles results in a higher concentration of lithium ions within the electrode material,along with the first principal stresses within the material particles.In addition,the convex particles increase the local stresses around the ball-shaped particle surface.Therefore,a round surface on the electrode material particles is beneficial for preventing potential fractures. 展开更多
关键词 Mechanical-chemical coupling lithium-ion battery diffusion-induced stress Surface microstructure
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A Numerical Study of the Double Diffusivity with Convective and Radiative Turbulent Flow in a Greenhouse with Humidity Sources
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作者 J.Serrano-Arellano M.I.Hernández-López +2 位作者 J.L.Chávez-Servín E.V.Macias-Melo K.M.Aguilar-Castro 《Frontiers in Heat and Mass Transfer》 2025年第6期1741-1765,共25页
A numerical study analyzed double diffusion caused by convective and radiative heat transfer in a greenhouse with and without internal humidity sources.Two cases were examined:one considering temperature and mass conc... A numerical study analyzed double diffusion caused by convective and radiative heat transfer in a greenhouse with and without internal humidity sources.Two cases were examined:one considering temperature and mass concentration gradients on vertical walls and another incorporating internal humidity sources,enhancing convective and diffusive flows.Four configurations were analyzed by varying the length of the greenhouse,and the Rayleigh number was calculated over a range from 2.29×10^(10) to 6.07×10^(12).Simulations modeled the greenhouse interior six times a day(8:00 a.m.to 7:00 p.m.),accounting for external temperature,humidity,and solar radiation.The Finite Volume Method solved the governing equations using the k-εturbulence model for the turbulent flow regime.Results showed a maximum temperature of 50℃ at 2:50 p.m.and a relative humidity of 84.12%.Adjusting inlet temperature and humidity effectively mitigated external weather effects.Adding humidity sources improved greenhouse performance,increasing humidity concentration by 4.93 to 5.35 times,particularly at 2:50 and 4:20 p.m.Convective and radiative Nusselt and Sherwood numbers were plotted for both cases,revealing higher humidity levels with internal sources,highlighting their importance in optimizing greenhouse microclimates. 展开更多
关键词 GREENHOUSE double diffusivity solar radiation turbulence model
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Effective diffusivity of a Janus sphere in an external field
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作者 Tianyu YUAN L.P.LIU Jianxiang WANG 《Applied Mathematics and Mechanics(English Edition)》 2025年第3期539-554,共16页
During nearly 200 years of development in the knowledge of Brownian motion,the Janus sphere,as a typical Brownian particle with special surface properties,has been widely studied in the past few decades.A standard Jan... During nearly 200 years of development in the knowledge of Brownian motion,the Janus sphere,as a typical Brownian particle with special surface properties,has been widely studied in the past few decades.A standard Janus sphere possesses two distinct surfaces.These two surfaces elicit different hydrodynamic interactions with ambient fluids or other interactions in response to environmental stimuli,such as chemical gradients,magnetic fields,and even light.The diffusion of Janus spheres,particularly when controlled by a remotely applied field,has inspired various applications,ranging from the design of micro-swimmers and novel procedures for probing the mechanical properties of suspensions to the fabrication of composites with enhanced performance.In this work,we report a systematic analysis of field-controlled diffusion of Janus spheres.Commencing with stochastic differential equations of motion at the microscale,we derive a coarse-grained Fokker-Planck equation at the macroscale,describing the evolution of the probability distribution function of the Janus sphere in terms of its position and orientation.Leveraging the concept of the hydrodynamic center,we derive,for the first time,explicit generalized Stokes-Einstein relations for long-time effective diffusivity,incorporating the effects of both the surface discontinuity of the Janus sphere and the external fields.The formulae enable predictions of the effective diffusivity as it varies with the slip length and characteristic angle of Janus spheres,and reveal the impact of an aligning potential field on the diffusion coefficients both parallel and perpendicular to the direction of the field.This work not only deepens the understanding of field-controlled diffusion of Janus particles,but also holds a meaningful impact on the future applications in microfluidics and related fields. 展开更多
关键词 Brownian motion effective diffusivity Janus sphere hydrodynamic center
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Improving PM_(2.5)simulation in the stable boundary layer over eastern China through parameterized minimum eddy diffusivity
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作者 Wen Lu Bin Zhu +3 位作者 Shuqi Yan Shuangshuang Shi Jie Li Zifa Wang 《Journal of Environmental Sciences》 2025年第12期254-264,共11页
Weak turbulence often occurs during heavy pollution events in eastern China(EC).However,existing mesoscale meteorology models cannot accurately simulate turbulent diffusion under weakened turbulence,particularly under... Weak turbulence often occurs during heavy pollution events in eastern China(EC).However,existing mesoscale meteorology models cannot accurately simulate turbulent diffusion under weakened turbulence,particularly under the nocturnal stable boundary layer(SBL),often leading to significant turbulent diffusivity underestimation and surface aerosol overestimation.In this study,a new parameterization of minimum turbulent diffusivity coefficient(Kz_(min))was tested and applied to PM_(2.5)simulations in EC under SBL conditions in WRF-Chem.The original model overestimated the PM_(2.5)simulation and the simulation performance can be improved by adding Kz_(min).Sensitivity experiments revealed different ranges of available Kz_(min)values over the northern(0.8 to 1.2 m^(2)/s)and southern(1.0 to 1.5 m^(2)/s)regions of EC.The geographically related Kz_(min)was parameterized by sensible heat flux(H)and latent heat flux(LE),which also exhibited regional differences related to the climate and underlying surface.Furthermore,we assign physical significance to the parameterized formula Kz_(min)and found that our proposed Kz_(min)scheme can reasonably yield dynamic Kz_(min)values over EC.The revised Kz_(min)scheme(EXP_(NEW))enhanced the turbulent diffusion(north:0.93 m^(2)/s,south:1.10 m^(2)/s on average)in the SBL,simultaneously improving the PM_(2.5)simulations on the surface(north:65.78 to 0.67μg/m^(3);south 30.48 to 12.86μg/m^(3))and upper SBL.A process analysis showed that vertical mixing was the key process for improving PM_(2.5)simulations on the surface in EXP_(NEW).This study highlighted the importance of improving turbulent diffusion in current mesoscale models under SBL and has great significance for aerosol simulation. 展开更多
关键词 WRF-Chem Stable boundary layer Minimum turbulent diffusivity PM_(2.5)simulation Process analysis
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Ultrahigh-Mass-Loading Electrodes With Enhanced Homogeneity Using a High-Concentration Slurry for Lithium-Ion Batteries
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作者 Jun Kyu Park Woohyeon Shin +14 位作者 Woohyeon Jo Hyo-Jeong Lee Won-Yong Jeon Jinho Ahn Jihee Yoon Yea-Ji Jeong Joonyoung Oh Minji Kang Min-Jae Choi Jin Joo Jongsoon Kim Seong-Keun Cho Jun Dong Park Jaewook Nam Jung-Keun Yoo 《Carbon Energy》 2026年第1期126-137,共12页
Strategies for achieving high-energy-density lithium-ion batteries include using high-capacity materials such as high-nickel NCM,increasing the active material content in the electrode by utilizing high-conductivity c... Strategies for achieving high-energy-density lithium-ion batteries include using high-capacity materials such as high-nickel NCM,increasing the active material content in the electrode by utilizing high-conductivity carbon nanotubes(CNT)conductive materials,and electrode thickening.However,these methods are still limited due to the limitation in the capacity of high-nickel NCM,aggregation of CNT conductive materials,and nonuniform material distribution of thick-film electrodes,which ultimately damage the mechanical and electrical integrity of the electrode,leading to a decrease in electrochemical performance.Here,we present an integrated binder-CNT composite dispersion solution to realize a high-solids-content(>77 wt%)slurry for high-mass-loading electrodes and to mitigate the migration of binder and conductive additives.Indeed,the approach reduces solvent usage by approximately 30%and ensures uniform conductive additive-binder domain distribution during electrode manufacturing,resulting in improved coating quality and adhesive strength for high-mass-loading electrodes(>12 mAh cm^(−2)).In terms of various electrode properties,the presented electrode showed low resistance and excellent electrochemical properties despite the low CNT contents of 0.6 wt%compared to the pristine-applied electrode with 0.85 wt%CNT contents.Moreover,our strategy enables faster drying,which increases the coating speed,thereby offering potential energy savings and supporting carbon neutrality in wet-based electrode manufacturing processes. 展开更多
关键词 cathodes DISPERSIBILITY dispersion solution high-mass-loading lithium-ion batteries
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Advanced direct recycling enables upcycling of spent lithium-ion batteries
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作者 Wei Liu Linfeng Peng +2 位作者 Ziqi Zeng Shijie Cheng Jia Xie 《Science China Chemistry》 2026年第2期619-639,共21页
The rapid expansion of lithium-ion batteries in electric vehicles and grid-scale energy storage intensify the demand for sustainable recycling strategies.Traditional metallurgical recycling methods face significant ch... The rapid expansion of lithium-ion batteries in electric vehicles and grid-scale energy storage intensify the demand for sustainable recycling strategies.Traditional metallurgical recycling methods face significant challenges,including high energy consumption,environmental pollution,and inefficient critical metals recovery.In contrast,advanced direct recycling can selectively extract valuable metals while preserving cathode structure,achieving over 99%lithium recovery from lithium iron phosphate.Moreover,by directly repairing defects and crystal structures of spent materials,their electrochemical performance can be effectively restored.Due to significantly reduced energy and reagent inputs,direct recycling cuts processing costs by over 20% and reduces waste emissions by at least 40% compared to conventional methods,making it a promising low-carbon alternative.This review systematically integrates the recent advances in direct recycling of spent batteries as well as the limitations and challenges of existing technologies,and proposes future research pathways to promote resource recycling and sustainable development. 展开更多
关键词 lithium-ion battery spent cathode direct recycling metal recovery SUSTAINABILITY
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Unified physics-informed subspace identification and transformer learning for lithium-ion battery state-of-health estimation
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作者 Yong Li Hao Wang +3 位作者 Chenyang Wang Liye Wang Chenglin Liao Lifang Wang 《Journal of Energy Chemistry》 2026年第1期350-369,I0009,共21页
The growing use of lithium-ion batteries in electric transportation and grid-scale storage systems has intensified the need for accurate and highly generalizable state-of-health(SOH)estimation.Conventional approaches ... The growing use of lithium-ion batteries in electric transportation and grid-scale storage systems has intensified the need for accurate and highly generalizable state-of-health(SOH)estimation.Conventional approaches often suffer from reduced accuracy under dynamically uncertain state-of-charge(SOC)operating ranges and heterogeneous aging stresses.This study presents a unified SOH estimation framework that integrates physics-informed modeling,subspace identification,and Transformer-based learning.A reduced-order model is derived from simplified electrochemical dynamics,providing an interpretable and computationally efficient representation of battery behavior.Subspace identification across a wide SOC and SOH range yields degradation-sensitive features,which the Transformer uses to capture long-range aging dynamics via multi-head self-attention.Experiments on LiFePO4 cells under joint-cell training show consistently accurate SOH estimation,with a maximum error of 1.39%,demonstrating the framework’s effectiveness in decoupling SOC and SOH effects.In cross-cell validation,where training and validation are performed on different cells,the model maintains a maximum error of 2.06%,confirming strong generalization to unseen aging trajectories.Comparative experiments on LiFePO_(4)and public LiCoO_(2)datasets confirm the framework’s cross-chemistry applicability.By extracting low-dimensional,physically interpretable features via subspace identification,the framework significantly reduces training cost while maintaining high SOH estimation accuracy,outperforming conventional data-driven models lacking physical guidance. 展开更多
关键词 lithium-ion battery Transformer learning Physics-informed modeling Subspace identification State-of-health estimation
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Synergistic fluorinated and non-fluorinated solvents for electrolytes of lithium-ion batteries at low temperatures
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作者 Xuning Gao Nan Piao +7 位作者 Yukun Yan Jinghao Wang Haolun Zou Siqi Guan Leiying Zeng Zhenhua Sun Guangjian Hu Feng Li 《Chinese Chemical Letters》 2026年第2期582-587,共6页
Commercial carbonate electrolytes suffer from ion transport difficulty in bulk electrolytes and interphase at low temperatures,bringing challenges to the application of lithium-ion batteries(LIBs)at low temperatures.H... Commercial carbonate electrolytes suffer from ion transport difficulty in bulk electrolytes and interphase at low temperatures,bringing challenges to the application of lithium-ion batteries(LIBs)at low temperatures.Herein,the ester solvent of methyl propionate(MP)with low melting point and low viscosity was used to tackle ion transport difficulty in electrolytes.Fluorinated ester was further added to accelerate interfacial transport through intermolecular interactions.The influence of fluorinated esters with different fluorination degrees on the solvation structure of electrolytes and the performance of batteries was further studied.As a result,methyl pentafluoropropionate(M5F)with five fluorine atoms was selected for its optimal interactions with both Li+and MP solvent in the primary solvation structure,contributing to desired solvation structure for fast interfacial transport.The LiFePO4(LFP)||graphite cell with LiFSI-MP-M5F electrolyte exhibited a high cyclability of 85.8%after 120 cycles and retained 81.2%of room-temperature capacity when charged and discharged at−30℃.1 Ah LFP||graphite pouch cell with high cathode loading(20 mg/cm^(2))in LiFSI-MP-M5F electrolyte exhibited 0.85 Ah capacity when charged and discharged at−20℃.This work provides a guidance for electrolyte design by synergistic fluorinated and non-fluorinated solvents for LIBs at low-temperature application. 展开更多
关键词 lithium-ion batteries ELECTROLYTE Fluorinated solvent Non-fluorinated solvent Solvation structure Low temperatures
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A Trajectory-Guided Diffusion Model for Consistent and Realistic Video Synthesis in Autonomous Driving
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作者 Beike Yu Dafang Wang 《Computer Modeling in Engineering & Sciences》 2026年第1期1075-1091,共17页
Scalable simulation leveraging real-world data plays an essential role in advancing autonomous driving,owing to its efficiency and applicability in both training and evaluating algorithms.Consequently,there has been i... Scalable simulation leveraging real-world data plays an essential role in advancing autonomous driving,owing to its efficiency and applicability in both training and evaluating algorithms.Consequently,there has been increasing attention on generating highly realistic and consistent driving videos,particularly those involving viewpoint changes guided by the control commands or trajectories of ego vehicles.However,current reconstruction approaches,such as Neural Radiance Fields and 3D Gaussian Splatting,frequently suffer from limited generalization and depend on substantial input data.Meanwhile,2D generative models,though capable of producing unknown scenes,still have room for improvement in terms of coherence and visual realism.To overcome these challenges,we introduce GenScene,a world model that synthesizes front-view driving videos conditioned on trajectories.A new temporal module is presented to improve video consistency by extracting the global context of each frame,calculating relationships of frames using these global representations,and fusing frame contexts accordingly.Moreover,we propose an innovative attention mechanism that computes relations of pixels within each frame and pixels in the corresponding window range of the initial frame.Extensive experiments show that our approach surpasses various state-of-the-art models in driving video generation,and the introduced modules contribute significantly to model performance.This work establishes a new paradigm for goal-oriented video synthesis in autonomous driving,which facilitates on-demand simulation to expedite algorithm development. 展开更多
关键词 Video generation autonomous vehicle diffusion model TRAJECTORY
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Tannin-derived sulfur-doped carbon with tunable porosity and dilated interlayer spacing for reversible Na-ion diffusion
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作者 Yu Su Jinbo Hu +6 位作者 Laiqiang Xu Xinwen Jiang Gonggang Liu Yuanjuan Bai Yuanyuan Liao Shanshan Chang Xiaowei Cheng 《Chinese Chemical Letters》 2026年第2期617-623,共7页
Hard carbon(HC)in sodium-ion batteries is searched by numerous investigations,which can offer the excellent performance of reversible Na^(+)insertion and extraction.The covalent heteroatom doping in HC is recently wor... Hard carbon(HC)in sodium-ion batteries is searched by numerous investigations,which can offer the excellent performance of reversible Na^(+)insertion and extraction.The covalent heteroatom doping in HC is recently worth concentrating,which can dilate the interlayer spacing of graphite to adjust the electrochemical storage performance in carbon anodes.However,the reported doping strategies of the modified HC have only resulted in limited improvement,especially unobvious effects on tuning porous structure.In this study,tannin extract and K_(2)SO_(4) are respectively utilized as carbon source and sulfur source for the fabrication of HC,in which K_(2)SO_(4) can contribute to the heteroatom doping,and the pore forming as well.The tannin-derived sulfur-doped carbon anode shows the excellent cycle stability,achieving a high reversible capacity of 520.5 mAh/g at a current density of 100 mA/g.Even after 500 cycles at a current density of 3 A/g,a high specific capacity of 236.7 mAh/g and a capacity retention rate of 92.6%can be reserved.Compared with the initial carbon,the adsorption energy of Na^(+)is multifold times higher,whereas Na^(+)diffusion energy barriers manyfold decrease.Moreover,the full battery assembled with Na_(3)V_(2)(PO_(4))_(3)/tannin-based HC demonstrates a stable cycling performance.This work can manifest the potentiality of the tannin-based electrode as anode for a high-performance sodium-ion batteries(SIBs),which could especially offer an explanation of Na^(+)storage and solid-electrolyte interface(SEI)stability to the electrochemical performance. 展开更多
关键词 Sulfur doping Tannin-derived carbon Sodium-ion diffusion SEI DFT
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A comprehensive review of remaining useful life prediction methods for lithium-ion batteries:Models,trends,and engineering applications
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作者 Yang Li Haotian Shi +5 位作者 Shunli Wang Qi Huang Chunmei Liu Shiliang Nie Xianyi Jia Tao Luo 《Journal of Energy Chemistry》 2026年第1期384-414,I0009,共32页
Under complex working conditions,accurate prediction of the remaining useful life(RUL)of lithium-ion batteries is of great significance to ensure the stable operation of energy storage systems,the safe driving of elec... Under complex working conditions,accurate prediction of the remaining useful life(RUL)of lithium-ion batteries is of great significance to ensure the stable operation of energy storage systems,the safe driving of electric vehicles,and the continuous power supply of electronic devices.This paper systematically describes the RUL prediction methods of lithium-ion batteries and comprehensively summarizes the development status and future trends in this field.First,the battery degradation mechanisms and lightweight data acquisition are analyzed.Secondly,a systematic classification model is constructed for the more widely used lithium battery RUL prediction methods,and the application characteristics and implementation limitations of different methods are analyzed in detail.An innovative classification framework for hybrid methods is proposed based on the depth of physical-data interaction.Then,collaborative modelling of calendar ageing and cyclic ageing is discussed,revealing their coupled effects and corresponding RUL prediction methods.Finally,the technical bottlenecks faced by the current RUL prediction of lithium batteries are identified,potential solutions are proposed,and the future development trends are outlined. 展开更多
关键词 lithium-ion batteries Remaining useful life Model-driven approach Data-driven approach Hybrid approach
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Low-Temperature Electrolytes for Lithium-Ion Batteries:Current Challenges,Development,and Perspectives
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作者 Yang Zhao Limin Geng +1 位作者 Weijia Meng Jiaye Ye 《Nano-Micro Letters》 2026年第2期692-741,共50页
Lithium-ion batteries(LIBs),while dominant in energy storage due to high energy density and cycling stability,suffer from severe capacity decay,rate capability degradation,and lithium dendrite formation under low-temp... Lithium-ion batteries(LIBs),while dominant in energy storage due to high energy density and cycling stability,suffer from severe capacity decay,rate capability degradation,and lithium dendrite formation under low-temperature(LT)operation.Therefore,a more comprehensive and systematic understanding of LIB behavior at LT is urgently required.This review article comprehensively reviews recent advancements in electrolyte engineering strategies aimed at improving the low-temperature operational capabilities of LIBs.The study methodically examines critical performance-limiting mechanisms through fundamental analysis of four primary challenges:insufficient ionic conductivity under cryogenic conditions,kinetically hindered charge transfer processes,Li+transport limitations across the solidelectrolyte interphase(SEI),and uncontrolled lithium dendrite growth.The work elaborates on innovative optimization approaches encompassing lithium salt molecular design with tailored dissociation characteristics,solvent matrix optimization through dielectric constant and viscosity regulation,interfacial engineering additives for constructing low-impedance SEI layers,and gel-polymer composite electrolyte systems.Notably,particular emphasis is placed on emerging machine learning-guided electrolyte formulation strategies that enable high-throughput virtual screening of constituent combinations and prediction of structure-property relationships.These artificial intelligence-assisted rational design frameworks demonstrate significant potential for accelerating the development of next-generation LT electrolytes by establishing quantitative composition-performance correlations through advanced data-driven methodologies. 展开更多
关键词 lithium-ion batteries Low-temperature electrolyte Solid electrolyte interphase Solvation structure Artificial intelligence-assisted design
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Global Stability of Traveling Wavefronts for a Belousov-Zhabotinsky Model with Mixed Nonlocal and Degenerate Diffusions
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作者 Yuting YANG Guobao ZHANG 《Journal of Mathematical Research with Applications》 2026年第1期87-102,共16页
In this paper,we are concerned with the stability of traveling wavefronts of a Belousov-Zhabotinsky model with mixed nonlocal and degenerate diffusions.Such a system can be used to study the competition among nonlocal... In this paper,we are concerned with the stability of traveling wavefronts of a Belousov-Zhabotinsky model with mixed nonlocal and degenerate diffusions.Such a system can be used to study the competition among nonlocally diffusive species and degenerately diffusive species.We prove that the traveling wavefronts are exponentially stable,when the initial perturbation around the traveling waves decays exponentially as x→-∞,but in other locations,the initial data can be arbitrarily large.The adopted methods are the weighted energy with the comparison principle and squeezing technique. 展开更多
关键词 Belousov-Zhabotinsky model nonlocal diffusion stability comparison principle weighted energy
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Molecular simulation of CH_(4)/CO_(2)/N_(2)ternary mixture competitive adsorption and diffusion dynamics in tight sandstone
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作者 Shihao Xu Cheng Cao +9 位作者 Yulong Zhao Liehui Zhang Qingping Li Shouwei Zhou Shaomu Wen Yong Hu Jinbu Li Yunsheng Wei Wei Xiong Bowen Guan 《Natural Gas Industry B》 2026年第1期77-92,共16页
Injecting impure CO_(2)for enhanced gas recovery(CO_(2)-EGR)offers a dual benefit by improving natural gas extraction while enabling CO_(2)sequestration.However,the interactions between CO_(2),N_(2),and CH_(4)under re... Injecting impure CO_(2)for enhanced gas recovery(CO_(2)-EGR)offers a dual benefit by improving natural gas extraction while enabling CO_(2)sequestration.However,the interactions between CO_(2),N_(2),and CH_(4)under reservoir conditions require further investigation.This study employs Grand Canonical Monte Carlo(GCMC)and Molecular Dynamics(MD)simulations to quantify the adsorption and diffusion behaviors of CO_(2),N_(2),and CH_(4)in quartz nanopores over a pressure range of 1-24 MPa under varying water saturations and gas compositions.The results indicate that:(1)CO_(2)exhibits the broadest energy distribution and the strongest adsorption stability,occupying about 20%-30%more adsorption sites than CH_(4)or N_(2)and showing the least sensitivity to water saturation,with only a 30%reduction at 50%saturation,compared to 60%for CH_(4),giving CO_(2)a clear competitive advantage.(2)The adsorption and desorption behaviors are strongly pressure dependent,as increasing pressure reduces the adsorption layer area and shifts gas distribution from adsorption dominated to free phase.Competitive adsorption analysis reveals that while CO_(2)dominates displacement at low pressures,mixtures that contain N_(2)achieve higher CH_(4)desorption efficiency above 13 MPa by mitigating diffusion resistance.(3)A higher N_(2)fraction improves CH_(4)diffusion coefficients,thereby facilitating gas mobility and ensuring superior recovery performance under high-pressure conditions.This study advances the fundamental knowledge of microscale gas behavior in tight sandstones and supports the feasibility of impure CO_(2)injection as a practical strategy for sustainable gas production. 展开更多
关键词 Competitive adsorption diffusion coefficient Ternary mixture Tight sandstone Molecular simulation
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Analysis of Geometrical Arrangement and Packing Material on Heat Generation in Lithium-Ion Battery Banks
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作者 Seenaa Khudhayer Salman Shaymaa Husham Abdulmalek +2 位作者 Ali Ahmed Gitan Thamer Khalif Salem Raaid Rashad Jassem Al-Doury 《Energy Engineering》 2026年第2期578-601,共24页
Operating Lithium-ion batteries at their temperature limits is a challenging design task due to explosion risk at high temperatures and rapid degradation at low temperatures.Depending on the battery package design,tho... Operating Lithium-ion batteries at their temperature limits is a challenging design task due to explosion risk at high temperatures and rapid degradation at low temperatures.Depending on the battery package design,those risks can be solved with passive solutions,which require no active cooling or heating.Thecurrentwork aims to optimize the pack design and materials of the type-NCR18650B battery based on a wide range of operation temperature.The lower limit was denoted by cold case while the maximum limit was expressed by hot case.A combined analyticalnumerical approach was developed to model the heat generation inside the battery.A thermal resistance analysis was used to determine the boundary conditions of the numerical model.The governing differential equations for the 1-D heat generation model were solved analytically.The numerical analysis was considered to determine the best battery pack design based on material parameters,number of batteries,and geometrical arrangement.The analytical results revealedthat the cold case canbe selectedas theworst case and thebestmodel wasobtainedusing thehexagonal-shaped 10-battery pack that was covered with Delrin of 1.8 mm in thickness.The numerical results showed that the best model was the hexagonal-shaped 10-battery pack with Delrin of 2 mm in thickness that achieved the largest temperature of−20.6℃ in the cold case. 展开更多
关键词 Analytical analysis battery package battery package configuration battery packing safety lithium-ion battery thermal performance
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Graph Guide Diffusion Solvers with Noises for Travelling Salesman Problem
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作者 Yan Kong Xinpeng Guo Chih-Hsien Hsia 《Computers, Materials & Continua》 2026年第3期689-707,共19页
With the development of technology,diffusion model-based solvers have shown significant promise in solving Combinatorial Optimization(CO)problems,particularly in tackling Non-deterministic Polynomial-time hard(NP-hard... With the development of technology,diffusion model-based solvers have shown significant promise in solving Combinatorial Optimization(CO)problems,particularly in tackling Non-deterministic Polynomial-time hard(NP-hard)problems such as the Traveling Salesman Problem(TSP).However,existing diffusion model-based solvers typically employ a fixed,uniform noise schedule(e.g.,linear or cosine annealing)across all training instances,failing to fully account for the unique characteristics of each problem instance.To address this challenge,we present GraphGuided Diffusion Solvers(GGDS),an enhanced method for improving graph-based diffusion models.GGDS leverages Graph Neural Networks(GNNs)to capture graph structural information embedded in node coordinates and adjacency matrices,dynamically adjusting the noise levels in the diffusion model.This study investigates the TSP by examining two distinct time-step noise generation strategies:cosine annealing and a Neural Network(NN)-based approach.We evaluate their performance across different problem scales,particularly after integrating graph structural information.Experimental results indicate that GGDS outperforms previous methods with average performance improvements of 18.7%,6.3%,and 88.7%on TSP-500,TSP-100,and TSP-50,respectively.Specifically,GGDS demonstrates superior performance on TSP-500 and TSP-50,while its performance on TSP-100 is either comparable to or slightly better than that of previous methods,depending on the chosen noise schedule and decoding strategy. 展开更多
关键词 Combinatorial optimization problem diffusion model noise schedule traveling salesman problem
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