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Long-term temporal-spatial dynamics of marine coastal water quality in the Tolo Harbor,Hong Kong,China 被引量:4
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作者 XUFu-liu K.C.LAM +2 位作者 R.W.Dawson TAOShu Y.D.CHEN 《Journal of Environmental Sciences》 SCIE EI CAS CSCD 2004年第1期161-166,共6页
The long-term temporal and spatial dynamics of marine coastal water quality in Tolo Harbor, Hong Kong were explored. The Harbor is divided into three zones represented as Harbor, Buffer, and Channel Subzones. The time... The long-term temporal and spatial dynamics of marine coastal water quality in Tolo Harbor, Hong Kong were explored. The Harbor is divided into three zones represented as Harbor, Buffer, and Channel Subzones. The time range for the study covers the period from the 1970s to the 1990s. The selected indicators for the comprehensive assessment of water quality consist of physical, chemical and biological aspects, including suspended solids(SS), Secchi disk depth(SD), 5-day biochemical oxygen demand(BOD\-5), total nitrogen(TN), total phosphorus(TP), faecal coliform, chlorophyll-a(Chl-a), and the number of red tide occurrences. The results indicated the presence of obvious temporal and spatial trends with regard to changes in water quality. Spatially, water quality in the Channel Subzone is the best, while that in the Harbor Subzone is the worst. On a temporal basis, the average trend from bad to good was 1980s>1990s>1970s as indicated by most of the selected water quality indicators. Water quality during the late 1980s reached its worst level with the lowest SD, the highest BOD\-5, TN, TP, Chl-a concentrations, and the number of red tide occurrences. These long-term temporal-spatial water quality trends were also found in other studies of the Tolo Harbor. The large quantity of pollutants produced as a result of increasing population, industrial and commercial actives, and urbanization and industrialization trends in both Shatin and Tai Po seem to be primarily responsible for the changes in marine coastal water quality. 展开更多
关键词 temporal-spatial dynamics water quality INDICATORS pollution load Tolo Harbor
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Mitochondrial dynamics dysfunction and neurodevelopmental disorders:From pathological mechanisms to clinical translation
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作者 Ziqi Yang Yiran Luo +5 位作者 Zaiqi Yang Zheng Liu Meihua Li Xiao Wu Like Chen Wenqiang Xin 《Neural Regeneration Research》 2026年第5期1926-1946,共21页
Mitochondrial dysfunction has emerged as a critical factor in the etiology of various neurodevelopmental disorders, including autism spectrum disorders, attention-deficit/hyperactivity disorder, and Rett syndrome. Alt... Mitochondrial dysfunction has emerged as a critical factor in the etiology of various neurodevelopmental disorders, including autism spectrum disorders, attention-deficit/hyperactivity disorder, and Rett syndrome. Although these conditions differ in clinical presentation, they share fundamental pathological features that may stem from abnormal mitochondrial dynamics and impaired autophagic clearance, which contribute to redox imbalance and oxidative stress in neurons. This review aimed to elucidate the relationship between mitochondrial dynamics dysfunction and neurodevelopmental disorders. Mitochondria are highly dynamic organelles that undergo continuous fusion and fission to meet the substantial energy demands of neural cells. Dysregulation of these processes, as observed in certain neurodevelopmental disorders, causes accumulation of damaged mitochondria, exacerbating oxidative damage and impairing neuronal function. The phosphatase and tensin homolog-induced putative kinase 1/E3 ubiquitin-protein ligase pathway is crucial for mitophagy, the process of selectively removing malfunctioning mitochondria. Mutations in genes encoding mitochondrial fusion proteins have been identified in autism spectrum disorders, linking disruptions in the fusion-fission equilibrium to neurodevelopmental impairments. Additionally, animal models of Rett syndrome have shown pronounced defects in mitophagy, reinforcing the notion that mitochondrial quality control is indispensable for neuronal health. Clinical studies have highlighted the importance of mitochondrial disturbances in neurodevelopmental disorders. In autism spectrum disorders, elevated oxidative stress markers and mitochondrial DNA deletions indicate compromised mitochondrial function. Attention-deficit/hyperactivity disorder has also been associated with cognitive deficits linked to mitochondrial dysfunction and oxidative stress. Moreover, induced pluripotent stem cell models derived from patients with Rett syndrome have shown impaired mitochondrial dynamics and heightened vulnerability to oxidative injury, suggesting the role of defective mitochondrial homeostasis in these disorders. From a translational standpoint, multiple therapeutic approaches targeting mitochondrial pathways show promise. Interventions aimed at preserving normal fusion-fission cycles or enhancing mitophagy can reduce oxidative damage by limiting the accumulation of defective mitochondria. Pharmacological modulation of mitochondrial permeability and upregulation of peroxisome proliferator-activated receptor gamma coactivator 1-alpha, an essential regulator of mitochondrial biogenesis, may also ameliorate cellular energy deficits. Identifying early biomarkers of mitochondrial impairment is crucial for precision medicine, since it can help clinicians tailor interventions to individual patient profiles and improve prognoses. Furthermore, integrating mitochondria-focused strategies with established therapies, such as antioxidants or behavioral interventions, may enhance treatment efficacy and yield better clinical outcomes. Leveraging these pathways could open avenues for regenerative strategies, given the influence of mitochondria on neuronal repair and plasticity. In conclusion, this review indicates mitochondrial homeostasis as a unifying therapeutic axis within neurodevelopmental pathophysiology. Disruptions in mitochondrial dynamics and autophagic clearance converge on oxidative stress, and researchers should prioritize validating these interventions in clinical settings to advance precision medicine and enhance outcomes for individuals affected by neurodevelopmental disorders. 展开更多
关键词 autophagic clearance autism spectrum disorders cellular homeostasis fusion and fission mitochondrial dynamics MITOPHAGY neural regeneration neuronal energy metabolism neurodevelopmental disorders oxidative stress
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Reversible encapsulation tailored interfacial dynamics for boosting the water-gas shift performance 被引量:1
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作者 Nanfang Tang Qinghao Shang +12 位作者 Shuai Chen Yuxia Ma Qingqing Gu Lu Lin Qike Jiang Guoliang Xu Chuntian Wu Bing Yang Zhijie Wu Hui Shi Jian Liu Wenhao Luo Yu Cong 《Chinese Journal of Catalysis》 2025年第1期394-403,共10页
Revealing the structure evolution of interfacial active species during a dynamic catalytic process is a challenging but pivotal issue for the rational design of high-performance catalysts.Here,we successfully prepare ... Revealing the structure evolution of interfacial active species during a dynamic catalytic process is a challenging but pivotal issue for the rational design of high-performance catalysts.Here,we successfully prepare sub-nanometric Pt clusters(~0.8 nm)encapsulated within the defects of CeO_(2)nanorods via an in-situ defect engineering methodology.The as-prepared Pt@d-CeO_(2)catalyst significantly boosts the activity and stability in the water-gas shift(WGS)reaction compared to other analogs.Based on controlled experiments and complementary(in-situ)spectroscopic studies,a reversible encapsulation induced by active site transformation between the Pt^(2+)-terminal hydroxyl and Pt^(δ+)-O vacancy species at the interface is revealed,which enables to evoke the enhanced performance.Our findings not only offer practical guidance for the design of high-efficiency catalysts but also bring a new understanding of the exceptional performance of WGS in a holistic view,which shows a great application potential in materials and catalysis. 展开更多
关键词 Interfacial dynamics HYDROXYLS Water-gas shiftreaction In-situspectroscopy
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Single-cell transcriptomics reveals the cellular dynamics of hexafluoropropylene oxide dimer acid in exerting mouse male reproductive toxicity 被引量:1
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作者 Xupeng Zang Yongzhong Wang +6 位作者 Lei Jiang Yuhao Qiu Yue Ding Shengchen Gu Gengyuan Cai Ting Gu Linjun Hong 《Journal of Animal Science and Biotechnology》 2025年第3期1073-1091,共19页
Background Hexafluoropropylene oxide dimer acid(GenX),a substitute for per-and polyfluoroalkyl substances,has been widely detected in various environmental matrices and foods recently,attracting great attention.Howeve... Background Hexafluoropropylene oxide dimer acid(GenX),a substitute for per-and polyfluoroalkyl substances,has been widely detected in various environmental matrices and foods recently,attracting great attention.However,a systematic characterization of its reproductive toxicity is still missing.This study aims to explore the male reproductive toxicity caused by GenX exposure and the potential cellular and molecular regulatory mechanisms behind it.Results Normally developing mice were exposed to GenX,and testicular tissue was subsequently analyzed and validated using single-cell RNA sequencing.Our results revealed that GenX induced severe testicular damage,disrupted the balance between undifferentiated and differentiated spermatogonial stem cells,and led to strong variation in the cellular dynamics of spermatogenesis.Furthermore,GenX exposure caused global upregulation of testicular somatic cellular inflammatory responses,increased abnormal macrophage differentiation,and attenuated fibroblast adhesion,disorganizing the somatic-germline interactions.Conclusions In conclusion,this study revealed complex cellular dynamics and transcriptome changes in mouse testis after GenX exposure,providing a valuable resource for understanding its reproductive toxicity. 展开更多
关键词 Cellular dynamics GenX Reproductive toxicity Single-cell RNA sequencing TESTIS
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Smart cities,smart systems:A comprehensive review of system dynamics model applications in urban studies in the big data era 被引量:2
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作者 Gift Fabolude Charles Knoble +1 位作者 Anvy Vu Danlin Yu 《Geography and Sustainability》 2025年第1期25-36,共12页
This paper addresses urban sustainability challenges amid global urbanization, emphasizing the need for innova tive approaches aligned with the Sustainable Development Goals. While traditional tools and linear models ... This paper addresses urban sustainability challenges amid global urbanization, emphasizing the need for innova tive approaches aligned with the Sustainable Development Goals. While traditional tools and linear models offer insights, they fall short in presenting a holistic view of complex urban challenges. System dynamics (SD) models that are often utilized to provide holistic, systematic understanding of a research subject, like the urban system, emerge as valuable tools, but data scarcity and theoretical inadequacy pose challenges. The research reviews relevant papers on recent SD model applications in urban sustainability since 2018, categorizing them based on nine key indicators. Among the reviewed papers, data limitations and model assumptions were identified as ma jor challenges in applying SD models to urban sustainability. This led to exploring the transformative potential of big data analytics, a rare approach in this field as identified by this study, to enhance SD models’ empirical foundation. Integrating big data could provide data-driven calibration, potentially improving predictive accuracy and reducing reliance on simplified assumptions. The paper concludes by advocating for new approaches that reduce assumptions and promote real-time applicable models, contributing to a comprehensive understanding of urban sustainability through the synergy of big data and SD models. 展开更多
关键词 Urban sustainability Smart cities System dynamics models Big data analytics Urban system complexity Data-driven urbanism
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Recent advancements of nonlinear dynamics in mode coupled microresonators:a review 被引量:1
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作者 Xuefeng WANG Zhan SHI +3 位作者 Qiqi YANG Yuzhi CHEN Xueyong WEI Ronghua HUAN 《Applied Mathematics and Mechanics(English Edition)》 2025年第2期209-232,共24页
Due to scale effects,micromechanical resonators offer an excellent platform for investigating the intrinsic mechanisms of nonlinear dynamical phenomena and their potential applications.This review focuses on mode-coup... Due to scale effects,micromechanical resonators offer an excellent platform for investigating the intrinsic mechanisms of nonlinear dynamical phenomena and their potential applications.This review focuses on mode-coupled micromechanical resonators,highlighting the latest advancements in four key areas:internal resonance,synchronization,frequency combs,and mode localization.The origin,development,and potential applications of each of these dynamic phenomena within mode-coupled micromechanical systems are investigated,with the goal of inspiring new ideas and directions for researchers in this field. 展开更多
关键词 mode coupling micro-electro-mechanical system(MEMS)resonator nonlinear dynamics
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Efficient and Stable Perovskite Solar Cells and Modules Enabled by Tailoring Additive Distribution According to the Film Growth Dynamics
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作者 Mengen Ma Cuiling Zhang +5 位作者 Yujiao Ma Weile Li Yao Wang Shaohang Wu Chong Liu Yaohua Mai 《Nano-Micro Letters》 SCIE EI CAS 2025年第2期387-400,共14页
Gas quenching and vacuum quenching process are widely applied to accelerate solvent volatilization to induce nucleation of perovskites in blade-coating method.In this work,we found these two pre-crystallization proces... Gas quenching and vacuum quenching process are widely applied to accelerate solvent volatilization to induce nucleation of perovskites in blade-coating method.In this work,we found these two pre-crystallization processes lead to different order of crystallization dynamics within the perovskite thin film,resulting in the differences of additive distribution.We then tailor-designed an additive molecule named 1,3-bis(4-methoxyphenyl)thiourea to obtain films with fewer defects and holes at the buried interface,and prepared perovskite solar cells with a certified efficiency of 23.75%.Furthermore,this work also demonstrates an efficiency of 20.18%for the large-area perovskite solar module(PSM)with an aperture area of 60.84 cm^(2).The PSM possesses remarkable continuous operation stability for maximum power point tracking of T_(90)>1000 h in ambient air. 展开更多
关键词 Gas quenching Additive distribution Buried passivation Blade coating Crystallization dynamics
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Discovery of selective HDAC6 inhibitors driven by artificial intelligence and molecular dynamics simulation approaches 被引量:1
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作者 Xingang Liu Hao Yang +10 位作者 Xinyu Liu Minjie Mou Jie Liu Wenying Yan Tianle Niu Ziyang Zhang He Shi Xiangdong Su Xuedong Li Yang Zhang Qingzhong Jia 《Journal of Pharmaceutical Analysis》 2025年第8期1860-1872,共13页
Increasing evidence showed that histone deacetylase 6(HDAC6)dysfunction is directly associated with the onset and progression of various diseases,especially cancers,making the development of HDAC6-targeted anti-tumor ... Increasing evidence showed that histone deacetylase 6(HDAC6)dysfunction is directly associated with the onset and progression of various diseases,especially cancers,making the development of HDAC6-targeted anti-tumor agents a research hotspot.In this study,artificial intelligence(AI)technology and molecular simulation strategies were fully integrated to construct an efficient and precise drug screening pipeline,which combined Voting strategy based on compound-protein interaction(CPI)prediction models,cascade molecular docking,and molecular dynamic(MD)simulations.The biological potential of the screened compounds was further evaluated through enzymatic and cellular activity assays.Among the identified compounds,Cmpd.18 exhibited more potent HDAC6 enzyme inhibitory activity(IC_(50)=5.41 nM)than that of tubastatin A(TubA)(IC_(50)=15.11 nM),along with a favorable subtype selectivity profile(selectivity index z 117.23 for HDAC1),which was further verified by the Western blot analysis.Additionally,Cmpd.18 induced G2/M phase arrest and promoted apoptosis in HCT-116 cells,exerting desirable antiproliferative activity(IC_(50)=2.59 mM).Furthermore,based on long-term MD simulation trajectory,the key residues facilitating Cmpd.18's binding were identified by decomposition free energy analysis,thereby elucidating its binding mechanism.Moreover,the representative conformation analysis also indicated that Cmpd.18 could stably bind to the active pocket in an effective conformation,thus demonstrating the potential for in-depth research of the 2-(2-phenoxyethyl)pyridazin-3(2H)-one scaffold. 展开更多
关键词 Artificial intelligence Virtual screening Compound-protein interaction Molecular dynamic simulation Selective HDAC6 inhibitor
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Applications of molecular dynamics simulation in studying shale oil reservoirs at the nanoscale:Advances,challenges and perspectives 被引量:1
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作者 Lu Wang Yi-Fan Zhang +6 位作者 Run Zou Yi-Fan Yuan Rui Zou Liang Huang Yi-Sheng Liu Jing-Chen Ding Zhan Meng 《Petroleum Science》 2025年第1期234-254,共21页
The global energy demand is increasing rapidly,and it is imperative to develop shale hydrocarbon re-sources vigorously.The prerequisite for enhancing the exploitation efficiency of shale reservoirs is the systematic e... The global energy demand is increasing rapidly,and it is imperative to develop shale hydrocarbon re-sources vigorously.The prerequisite for enhancing the exploitation efficiency of shale reservoirs is the systematic elucidation of the occurrence characteristics,flow behavior,and enhanced oil recovery(EOR)mechanisms of shale oil within commonly developed nanopores.Molecular dynamics(MD)technique can simulate the occurrence,flow,and extraction processes of shale oil at the nanoscale,and then quantitatively characterize various fluid properties,flow characteristics,and action mechanisms under different reservoir conditions by calculating and analyzing a series of MD parameters.However,the existing review on the application of MD simulation in shale oil reservoirs is not systematic enough and lacks a summary of technical challenges and solutions.Therefore,recent MD studies on shale oil res-ervoirs were summarized and analyzed.Firstly,the applicability of force fields and ensembles of MD in shale reservoirs with different reservoir conditions and fluid properties was discussed.Subsequently,the calculation methods and application examples of MD parameters characterizing various properties of fluids at the microscale were summarized.Then,the application of MD simulation in the study of shale oil occurrence characteristics,flow behavior,and EOR mechanisms was reviewed,along with the elucidation of corresponding micro-mechanisms.Moreover,influencing factors of pore structure,wall properties,reservoir conditions,fluid components,injection/production parameters,formation water,and inorganic salt ions were analyzed,and some new conclusions were obtained.Finally,the main challenges associated with the application of MD simulations to shale oil reservoirs were discussed,and reasonable prospects for future MD research directions were proposed.The purpose of this review is to provide theoretical basis and methodological support for applying MD simulation to study shale oil reservoirs. 展开更多
关键词 Molecular dynamics Shale oil reservoirs NANOPORES Enhanced oil recovery Fluid flow behavior Shale oil occurrence
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Efficient and Stable Photoassisted Lithium‑Ion Battery Enabled by Photocathode with Synergistically Boosted Carriers Dynamics
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作者 Zelin Ma Shiyao Wang +13 位作者 Zhuangzhuang Ma Juan Li Luomeng Zhao Zhihuan Li Shiyuan Wang Yazhou Shuang Jiulong Wang Fang Wang Weiwei Xia Jie Jian Yibo He Junjie Wang Pengfei Guo Hongqiang Wang 《Nano-Micro Letters》 SCIE EI CAS 2025年第3期440-454,共15页
Efficient and stable photocathodes with versatility are of significance in photoassisted lithium-ion batteries(PLIBs),while there is always a request on fast carrier transport in electrochemical active photocathodes.P... Efficient and stable photocathodes with versatility are of significance in photoassisted lithium-ion batteries(PLIBs),while there is always a request on fast carrier transport in electrochemical active photocathodes.Present work proposes a general approach of creating bulk heterojunction to boost the carrier mobility of photocathodes by simply laser assisted embedding of plasmonic nanocrystals.When employed in PLIBs,it was found effective for synchronously enhanced photocharge separation and transport in light charging process.Additionally,experimental photon spectroscopy,finite difference time domain method simulation and theoretical analyses demonstrate that the improved carrier dynamics are driven by the plasmonic-induced hot electron injection from metal to TiO_(2),as well as the enhanced conductivity in TiO2 matrix due to the formation of oxygen vacancies after Schottky contact.Benefiting from these merits,several benchmark values in performance of TiO2-based photocathode applied in PLIBs are set,including the capacity of 276 mAh g^(−1) at 0.2 A g^(−1) under illumination,photoconversion efficiency of 1.276%at 3 A g^(−1),less capacity and Columbic efficiency loss even through 200 cycles.These results exemplify the potential of the bulk heterojunction strategy in developing highly efficient and stable photoassisted energy storage systems. 展开更多
关键词 Photoassisted lithium-ion batteries Bulk heterojunction Carrier dynamics TiO2 nanofiber Plasmonic metal nanocrystals
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Three-stage approach for dynamic traffic temporal-spatial model
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作者 陆化普 孙智源 屈闻聪 《Journal of Central South University》 SCIE EI CAS CSCD 2016年第10期2728-2734,共7页
In order to describe the characteristics of dynamic traffic flow and improve the robustness of its multiple applications, a dynamic traffic temporal-spatial model(DTTS) is established. With consideration of the tempor... In order to describe the characteristics of dynamic traffic flow and improve the robustness of its multiple applications, a dynamic traffic temporal-spatial model(DTTS) is established. With consideration of the temporal correlation, spatial correlation and historical correlation, a basic DTTS model is built. And a three-stage approach is put forward for the simplification and calibration of the basic DTTS model. Through critical sections pre-selection and critical time pre-selection, the first stage reduces the variable number of the basic DTTS model. In the second stage, variable coefficient calibration is implemented based on basic model simplification and stepwise regression analysis. Aimed at dynamic noise estimation, the characteristics of noise are summarized and an extreme learning machine is presented in the third stage. A case study based on a real-world road network in Beijing, China, is carried out to test the efficiency and applicability of proposed DTTS model and the three-stage approach. 展开更多
关键词 dynamic traffic flow temporal-spatial model big-data driven
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A Study on the Rail Transit Economic Field and Its Interactive Development Relationship with Cities from the Temporal-Spatial Perspective
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作者 Xiaorong Wang 《Proceedings of Business and Economic Studies》 2025年第5期11-19,共9页
As metropolitan areas expand spatially,they encounter constraints imposed by the fixed daily time budget.Rail transit enhances transport efficiency,reduces costs,and facilitates the formation of a“transit economic fi... As metropolitan areas expand spatially,they encounter constraints imposed by the fixed daily time budget.Rail transit enhances transport efficiency,reduces costs,and facilitates the formation of a“transit economic field”centered on rail networks,thereby alleviating such temporal-spatial pressures.This paper adopts an integrated temporal-spatial analytical framework.Following a conceptual clarification of the transit economic field,it dissects the mechanisms through which rail transit improves mobility and examines how this field influences urban spatial patterns,temporal dynamics,and their interrelationships.It constructs a theoretical framework to explain the co-development of transit economic fields and cities,supplemented by empirical case studies.The key findings are as follows:Firstly,the transit economic field represents a high-density development model that expands both horizontally and vertically around rail networks.It mitigates temporal-spatial conflicts.Secondly,with rail networks as the core,the field integrates diverse spatial functions,facilitating the establishment of economic connections and stabilizing temporal-spatial relationships.Thirdly,the transit economic field contributes to the preservation of urban natural ecosystems and enhances urban livability.Overall,this research can provide insights for promoting rail transit-oriented development transitions in large cities and urban agglomerations. 展开更多
关键词 Rail transit Rail transit economic field temporal-spatial relationship ACCESSIBILITY
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Time-resolved Electroluminescence of Charge Carrier Dynamics in Multiple-emitting-layer White QLEDs with Polyethyleneimine Interlayers
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作者 YAN Shanshan WANG Shen +2 位作者 LIANG Wencheng LIU Weiwei KONG Youchao 《发光学报》 北大核心 2025年第10期1851-1861,共11页
The charge carrier transport and recombination dynamics in the quantum dots-based light-emitting diodes(QLEDs)featuring multiple emitting layers(M-EMLs)has a great impact on the device performance.In this work,QLEDs b... The charge carrier transport and recombination dynamics in the quantum dots-based light-emitting diodes(QLEDs)featuring multiple emitting layers(M-EMLs)has a great impact on the device performance.In this work,QLEDs based on M-EMLs separated by polyethyleneimine ethoxylated(PEIE)layer with different stacking sequences of blue(B),green(G),and red(R)QDs layer were used to intuitively explore the injection,transportation and recombination processes of the charge carriers in QLEDs by using the time-resolved electroluminescence(TrEL)spectra.From the TrEL spectra mea-surements,green and red emissions were obtained first in the QLEDs with the EMLs sequences of G/PEIE/B/PEIE/R and B/PEIE/R/PEIE/G along the direction of light emission,respectively.While the QLEDs adopt EMLs sequences of B/PEIE/G/PEIE/R,the blue,green and red emissions were obtained nearly at the same time.The above phenomenon can be attributed to different charge carrier transmission and radiation recombination process in the EMLs due to different valence band offsets and conduction band offsets between R-,G-and B-QDs by using different sequences of EMLs.White emission with coordi-nates of(0.31,0.31)and correlated color temperature(CCT)of 5916 K was obtained in the QLEDs with the EMLs se-quences of B/PEIE/G/PEIE/R,which can be attributed to the relative uniform emission of B-,G-and R-QDs due to the effec-tive injection and radiation recombination of charge carriers in each of the EMLs.The above results have great significance for further understanding and improving the performance of QLEDs with M-EMLs. 展开更多
关键词 white QLEDs multiple emitting layers TrEL spectra charge carrier dynamics
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Active species in carbon nanotube nucleation from acetylene:Insights from nanoreactor molecular dynamics
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作者 LI Luotong LEI Tingyu +3 位作者 BAI Jiawei LIU Xingchen TENG Botao WEN Xiaodong 《燃料化学学报(中英文)》 北大核心 2025年第12期1843-1852,共10页
Carbon nanotube formation exemplifies atomically precise self-assembly,where atomic interactions dynamically engineer nanoscale architectures with emergent properties that transcend classical material boundaries.Howev... Carbon nanotube formation exemplifies atomically precise self-assembly,where atomic interactions dynamically engineer nanoscale architectures with emergent properties that transcend classical material boundaries.However,elucidating the transient molecular intermediates remains a critical mechanistic frontier.This study investigates the atomic-scale nucleation process of single-walled carbon nanotubes(SWCNTs)from acetylene on iron(Fe)clusters,utilizing GFN(-x)TB-based nanoreactor molecular dynamics simulations.The simulations reveal a consistent nucleation pathway,regardless of iron cluster size(Fe_(13),Fe_(38),Fe_(55)),where the chemisorption and dissociation of acetylene molecules on the Fe clusters lead to the formation of C_(2)H and C_(2)intermediates.These species then undergo oligomerization,initiating the growth of carbon chains.As the chains cross-link and cyclize,five-membered carbon rings are preferentially formed,which eventually evolve into six-membered rings and more complex sp2-hybridized carbon networks,resembling the cap structures of nascent SWCNTs.Although the nucleation mechanism remains similar across all cluster sizes,larger clusters show enhanced catalytic activity,leading to higher molecular weight hydrocarbons and more extensive carbocyclic networks due to their higher density of active sites per reacting molecule.Crucially,the study highlights the role of C_(2)H as the key active species in the carbon network formation process.These findings offer critical insights into the initial stages of SWCNT nucleation,contributing to a deeper understanding of the mechanisms driving SWCNT growth and guiding the development of optimized synthetic strategies. 展开更多
关键词 single-walled carbon nanotubes molecular dynamics simulation nucleation mechanism acetylene dissociation
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Graphene Size Dependent Hardness and Strengthening Mechanisms of Cu/Graphene Composites:A Molecular Dynamics Study
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作者 Zhang Shuang Chang Guo +5 位作者 Li Liang Li Xiang Peng Haoran Chen Kaiyun Yang Nan Huo Wangtu 《稀有金属材料与工程》 北大核心 2025年第1期17-26,共10页
The extraordinary strength of metal/graphene composites is significantly determined by the characteristic size,distribution and morphology of graphene.However,the effect of the graphene size/distribution on the mechan... The extraordinary strength of metal/graphene composites is significantly determined by the characteristic size,distribution and morphology of graphene.However,the effect of the graphene size/distribution on the mechanical properties and related strengthening mechanisms has not been fully elucidated.Herein,under the same volume fraction and distribution conditions of graphene,molecular dynamics simulations were used to investigate the effect of graphene sheet size on the hardness and deformation behavior of Cu/graphene composites under complex stress field.Two models of pure single crystalline Cu and graphene fully covered Cu matrix composite were constructed for comparison.The results show that the strengthening effect changes with varying the graphene sheet size.Besides the graphene dislocation blocking effect and the load-bearing effect,the deformation mechanisms change from stacking fault tetrahedron,dislocation bypassing and dislocation cutting to dislocation nucleation in turn with decreasing the graphene sheet size.The hardness of Cu/graphene composite,with the graphene sheet not completely covering the metal matrix,can even be higher than that of the fully covered composite.The extra strengthening mechanisms of dislocation bypassing mechanism and the stacking fault tetrahedra pinning dislocation mechanism contribute to the increase in hardness. 展开更多
关键词 Cu/graphene composites graphene size HARDNESS strengthening mechanism molecular dynamics
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Magnetic-Mediated Carrier, Phonon and Spin Dynamics in the Ferromagnetic Semiconductor (In,Fe)Sb
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作者 K.Hu X.H.Zhu +2 位作者 H.L.Wang D.H.Wei J.Qi 《Chinese Physics Letters》 2025年第5期206-214,共9页
We investigate the carrier, phonon, and spin dynamics in the ferromagnetic semiconductor(In,Fe)Sb using ultrafast optical pump-probe spectroscopy. We discover two anomalies near T^(*)(~40 K) and T^(†)(~200 K) in the p... We investigate the carrier, phonon, and spin dynamics in the ferromagnetic semiconductor(In,Fe)Sb using ultrafast optical pump-probe spectroscopy. We discover two anomalies near T^(*)(~40 K) and T^(†)(~200 K) in the photoexcited carrier dynamics, which can be attributed to the electron-spin and spin-lattice scattering processes influenced by the magnetic phase transition and modifications in magnetic anisotropy. The magnetization change can be revealed by the dynamics of coherent acoustic phonon. We also observe abrupt changes in the photoinduced spin dynamics near T^(*)and T^(†), which not only illustrate the spin-related scatterings closely related to the long-range magnetic order, but also reveal the D'yakonov–Perel and Elliott–Yafet mechanisms dominating at temperatures below and above T^(†), respectively. Our findings provide important insights into the nonequilibrium properties of the photoexcited(In,Fe)Sb. 展开更多
关键词 magnetization change photoexcited carrier dynamics spin dynamics magnetic mediated carrier dynamics ferromagnetic semiconductor modifications magnetic anisotropy phonon dynamics coherent acoustic phonon
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Stability assessment of inverter-dominated power systems considering coupling between phase angle and voltage dynamics
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作者 Cong Fu Shuiping Zhang +1 位作者 Shun Li Feng Liu 《iEnergy》 2025年第3期157-164,共8页
The integration of renewable energy sources(RESs)with inverter interfaces has fundamentally reshaped power system dynamics,challenging traditional stability analysis frameworks designed for synchronous generator-domin... The integration of renewable energy sources(RESs)with inverter interfaces has fundamentally reshaped power system dynamics,challenging traditional stability analysis frameworks designed for synchronous generator-dominated grids.Conventional classifica-tions,which decouple voltage,frequency,and rotor angle stability,fail to address the emerging strong voltage‒angle coupling effects caused by RES dynamics.This coupling introduces complex oscillation modes and undermines system robustness,neces-sitating novel stability assessment tools.Recent studies focus on eigenvalue distributions and damping redistribution but lack quantitative criteria and interpretative clarity for coupled stability.This work proposes a transient energy-based framework to resolve these gaps.By decomposing transient energy into subsystem-dissipated components and coupling-induced energy exchange,the method establishes stability criteria compatible with a broad variety of inverter-interfaced devices while offering an intuitive energy-based interpretation for engineers.The coupling strength is also quantified by defining the relative coupling strength index,which is directly related to the transient energy interpretation of the coupled stability.Angle‒voltage coupling may induce instability by injecting transient energy into the system,even if the individual phase angle and voltage dynamics themselves are stable.The main contributions include a systematic stability evaluation framework and an energy decomposition approach that bridges theoretical analysis with practical applicability,addressing the urgent need for tools for managing modern power system evolving stability challenges. 展开更多
关键词 Power system stability dynamic coupling inverter-interfaced device stability criteria phase angle dynamics voltage dynamics
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Driven Critical Dynamics in the Tricitical Point
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作者 Ting-Long Wang Yi-Fan Jiang Shuai Yin 《Chinese Physics Letters》 2025年第11期1-8,共8页
The conventional Kibble–Zurek mechanism,describing driven dynamics across critical points based on the adiabatic-impulse scenario(AIS),has attracted broad attention.However,the driven dynamics at the tricritical poin... The conventional Kibble–Zurek mechanism,describing driven dynamics across critical points based on the adiabatic-impulse scenario(AIS),has attracted broad attention.However,the driven dynamics at the tricritical point with two independent relevant directions have not been adequately studied.Here,we employ the time-dependent variational principle to study the driven critical dynamics at a one-dimensional supersymmetric Ising tricritical point.For the relevant direction along the Ising critical line,the AIS apparently breaks down.Nevertheless,we find that the critical dynamics can still be described by finite-time scaling in which the driving rate has a dimension of r_(μ)=z+1/v_(μ)with z and v_(μ)being the dynamic exponent and correlation length exponent in this direction,respectively.For driven dynamics along another direction,the driving rate has a dimension of r_(p)=z+1/v_(p)with v_(p)being another correlation length exponent.Our work brings a new fundamental perspective into nonequilibrium critical dynamics near the tricritical point,which could be realized in programmable quantum processors in Rydberg atomic systems. 展开更多
关键词 driven dynamics across critical points finite time scaling dynamic exponent driven dynamics time dependent variational principle Kibble Zurek mechanism tricritical point driven critical dynamics
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Deployment dynamics and experiments of a tendon-actuated flexible manipulator
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作者 Benteng ZHANG Jialiang SUN Haiyan HU 《Chinese Journal of Aeronautics》 2025年第2期459-477,共19页
The quantity of space debris on Earth orbit has escalated tremendously in recent years, presenting a significant hazard to human space operations. It is urgent to develop effective measures to capture and remove vario... The quantity of space debris on Earth orbit has escalated tremendously in recent years, presenting a significant hazard to human space operations. It is urgent to develop effective measures to capture and remove various space debris. For this purpose, this paper presents a tendon-actuated flexible deployable manipulator. The flexible manipulator consists of several deployable units connected by Cardan joints and actuated by tendons. Compared with the present technologies for capturing space debris such as rigid robotic arm or flying net, this flexible manipulator is deployable, reusable, lightweight and applicable to the capture of large space debris. In order to investigate its deployment dynamics, an accurate dynamic model of the flexible manipulator is established based on the natural coordinate formulation (NCF) and the absolute nodal coordinate formulation (ANCF). Subsequently, numerical simulations are carried out to study the effects of system parameters and the base satellite on its deployment dynamics. Finally, ground experiments for both deployment and bending of the flexible manipulator are conducted to verify its effectiveness and feasibility. 展开更多
关键词 Flexible manipulator Tendon-actuated dynamic modeling Deployment dynamics Ground experiments
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Generation and dynamics of special mode-locked pulses in an ultrafast Er-doped fiber laser with SMF-GIMF-SMF saturable absorber 被引量:1
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作者 LIN Yingjie ZENG Qiong +3 位作者 JI Yubo SONG Yufeng WANG Ke WANG Zhenhong 《Optoelectronics Letters》 2025年第5期265-270,共6页
In this paper, we have demonstrated an Er-doped ultrafast laser with a single mode fiber-gradient index multimode fiber-single mode fiber(SMF-GIMF-SMF, SMS) structure as saturable absorber(SA), which can generate not ... In this paper, we have demonstrated an Er-doped ultrafast laser with a single mode fiber-gradient index multimode fiber-single mode fiber(SMF-GIMF-SMF, SMS) structure as saturable absorber(SA), which can generate not only stable single-pulse state, but also special mode-locked pulses with the characteristics of high energy and noisy behaviors at proper pump power and cavity polarization state. In addition, we have deeply investigated the real-time spectral evolutions of the mode-locked pulses through the dispersive Fourier transformation(DFT) technique. It can be found that the pulse regime can actually consist of a lot of small noise pulses with randomly varying intensities. We believe that these results will further enrich the nonlinear dynamical processes in the ultrafast lasers. 展开更多
关键词 ultrafast laser ER doped fiber SMF GIMF SMF dispersive Fourier transformation saturable absorber sa mode locked pulses nonlinear dynamics saturable absorber
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