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Crystal reconstruction of V_(2)O_(3)/carbon heterointerfaces via anodic hydration for ultrafast and reversible Mg-ion battery cathodes

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InfoMat 2024年第3期6卷 95-107页

作者： Gun Jang Yun Sang Joe Sang Joon Lee Hyun Gyu Cho Sang Ha Baek Peixun Xiong Kang Ho Shin Jeong Seok Yeon Min Su Kang Si Hyoung Oh Ho Seok Park School of Chemical Engineering Sungkyunkwan University(SKKU)SuwonRepublic of Korea Advanced Batteries Research Center Korea Electronics Technology InstituteSeongnamRepublic of Korea Korea Institute of Science and Technology SeoulRepublic of Korea SKKU Advanced Institute of Nano Technology(SAINT) Sungkyunkwan UniversitySuwonRepublic of Korea Department of Health Sciences and Technology Samsung Advanced Institute for Health Sciences and Technology(SAIHST)Sungkyunkwan UniversitySuwonRepublic of Korea SKKU Institute of Energy Science and Technology(SIEST) Sungkyunkwan UniversitySuwonRepublic of Korea

Magnesium-ion batteries(MIBs)have promising applications because of their high theoretical capacity and the natural abundance of magnesium ***,the kinetic performance and cyclic stability of cathode materials are limited by the strong interactions between Mg ions and the crystal ***,we demonstrate the unique Mg^(2+)-ion storage mechanism of a hierarchical accordion-like vanadium oxide/carbon heterointerface(V_(2)O_(3)@C),where the V_(2)O_(3) crystalline structure is reconstructed into a MgV_(3)O_(7)·H_(2)O phase through an anodic hydration reaction upon first cycle,for the improved kinetic and cyclic *** verified by in situ/ex situ spectroscopic and electrochemical analyses,the fast charge transfer kinetics of the V_(2)O_(3)@C cathode were due to the crystal-reconstruction and chemically coupled *** V_(2)O_(3)@C demonstrated an ultrahigh rate capacity of 130.4 mAh g^(-1)at 50000 mA g^(-1)and 1000 cycles,achieving a Coulombic efficiency of 99.6%.The high capacity of 381.0 mA h g^(-1)can be attributed to the reversible Mg^(2+)-ion intercalation mechanism observed in the MgV_(3)O_(7)·H_(2)O phase using a 0.3 M Mg(TFSI)2/ACN(H_(2)O)***,within the voltage range of 2.25 V versus Mg/Mg^(2+),the V_(2)O_(3)@C exhibited a capacity of 245.1 mAh g^(-1)when evaluated with magnesium metal in a 0.3 M Mg(TFSI)^(2+)0.25 M MgCl_(2)/DME *** research findings have important implications for understanding the relationship between the Mg-ion storage mechanism and reconstructed crystal phase of vanadium oxides as well as the heterointerface reconstruction for the rational design of MIB cathode materials.

关键词： anodic hydration reaction magnesium ion battery nano crystal vanadium oxide

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In-Depth Study of Potential-Based Routing and New Exploration of Its Scheduling Integration

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Computer Modeling in engineering & sciences 2024年第9期140卷 2891-2911页

作者： Jihoon Sung Yeunwoong Kyung Department of Electrical Engineering Korea Advanced Institute of Science and TechnologyDaejeon34141Republic of Korea Division of Information&Communication Engineering Kongju National UniversityCheonan31080Republic of Korea

Industrial wireless mesh networks(WMNs)have been widely deployed in various industrial sectors,providing services such as manufacturing process monitoring,equipment control,and sensor data collection.A notable characteristic of industrial WMNs is their distinct traffic pattern,where the majority of traffic flows originate from mesh nodes and are directed towards mesh *** this context,this paper adopts and revisits a routing algorithm known as ALFA(autonomous load-balancing field-based anycast routing),tailored specifically for anycast(one-to-one-of-many)networking in WMNs,where traffic flows can be served through any one of multiple *** essence,the scheme is a hybrid-type routing strategy that leverages the advantages of both back-pressure routing and geographic ***,its novelty lies in being developed by drawing inspiration from another field,specifically from the movement of charges in an electrostatic potential *** on the previous work,this paper explores further in-depth discussions that were not previously described,including a detailed description of the analogy between an electrostatic system and a WMN system based on precise mapping perspectives derived from intensive analysis,as well as discussions on anycast,numerical methods employed in devising the ALFA scheme,its characteristics,and *** is worth noting that this paper addresses these previously unexplored aspects,representing significant contributions compared to previous *** a completely new exploration,a new scheduling strategy is proposed that is compatible with the routing approach by utilizing the potential-based metric not only in routing but also in *** assigns higher medium access priority to links with a larger potential *** simulation results demonstrate the superior performance of the proposed potential-based joint routing and scheduling scheme across various aspects within industrial WMN scenarios.

关键词： Potential-based routing potential differential scheduling industrial wireless mesh networks

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Towards high-performance and robust anion exchange membranes(AEMs)for water electrolysis:Super-acid-catalyzed synthesis of AEMs

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Journal of Energy Chemistry 2024年第6期93卷 478-510,I0012页

作者： Geun Woong Ryoo Sun Hwa Park Ki Chang Kwon Jong Hun Kang Ho Won Jang Min Sang Kwon Department of Materials Science and Engineering Research Institute of Advanced Materials(RIAM)Seoul National UniversitySeoul 08826Republic of Korea Interdisciplinary Materials Measurement Institute Korea Research Institute of Standards and Science(KRISS)Daejeon 34113Republic of Korea Department of Chemical and Biological Engineering and Institute of Chemical ProcessSeoul National UniversitySeoul 08826Republic of Korea Department of Applied Measurement Science University of Science and TechnologyDaejeon 34113Republic of Korea

The increasing demand for hydrogen energy to address environmental issues and achieve carbon neutrality has elevated interest in green hydrogen production,which does not rely on fossil *** various hydrogen production technologies,anion exchange membrane water electrolyzer(AEMWE)has emerged as a next-generation technology known for its high hydrogen production efficiency and its ability to use non-metal ***,this technology faces significant challenges,particularly in terms of the membrane durability and low ionic *** address these challenges,research efforts have focused on developing membranes with a new backbone structure and anion exchange groups to enhance durability and ionic ***,the super-acid-catalyzed condensation(SACC)synthesis method stands out due to its user convenience,the ability to create high molecular weight(MW)polymers,and the use of oxygen-tolerant organic *** the synthesis of anion exchange membranes(AEMs)using the SACC method began in 2015,and despite growing interest in this synthesis approach,there remains a scarcity of review papers focusing on AEMs synthesized using the SACC *** review covers the basics of SACC synthesis,presents various polymers synthesized using this method,and summarizes the development of these polymers,particularly their building blocks including aryl,ketone,and anion exchange *** systematically describe the effects of changes in the molecular structure of each polymer component,conducted by various research groups,on the mechanical properties,conductivity,and operational stability of the *** review will provide insights into the development of AEMs with superior performance and operational stability suitable for water electrolysis applications.

关键词： Green hydrogen production Water electrolysis Anion exchange membrane water electrolyzer(AEMWE) Anion exchange membranes(AEMs) Super-acid-catalyzed condensation(SACC)

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Solution-flame hybrid synthesis of defect-enriched mesoporous CuO_(x) nanowires for enhanced electrochemical nitrate-to-ammonia production

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Journal of Energy Chemistry 2024年第12期99卷 475-483页

作者： Li Qu Sungkyu Kim Runfa Tan Arumugam Sivanantham Seokgi Kim Yoo Jae Jeong Min Cheol Kim Seong Sik Shin Uk Sim In Sun Cho Department of Materials Science&Engineering Ajou UniversitySuwon 16499Republic of Korea Department of Energy Systems Research Ajou UniversitySuwon 16499Republic of Korea Department of Nanotechnology and Advanced Materials Engineering Sejong UniversitySeoul 05006Republic of Korea Department of Chemistry Sookmyung Women's UniversitySeoul 04310Republic of Korea Department of Nano Engineering and Department of Nano Science and Technology SKKU Advanced Institute of Nanotechnology(SAINT)Sungkyunkwan UniversitySuwonRepublic of Kore SKKU Institute of Energy Science and Technology(SIEST) Sungkyunkwan UniversitySuwonRepublic of Kore School of Energy Technology Korea Institute of Energy Technology(KENTECH)Jeonnam 58217Republic of Korea

Electrochemical nitrate reduction(ENR)is an economical and eco-friendly method for converting industrial wastewater into valuable ammonia under atmospheric *** main challenge lies in designing and developing highly durable ENR *** study introduces defect-rich mesoporous CuO_(x) nanowires electrocatalyst synthesized using a novel solution-flame(sol-flame)hybrid method to control mesoporosity and introduce surface defects,thereby enhancing the electrochemical nitrate-toammonia production *** found surface defects(oxygen vacancies and Cu^(+))and unique mesoporous nanowire structure composed of tightly interconnected *** sol-flamesynthesized CuO_(x) nanowires(sf-CuO NWs)achieved superior ammonia yield rate(0.51 mmol h^(-1)cm^(-2)),faradaic efficiency(97.3%),and selectivity(86.2%)in 1 M KOH electrolyte(2000 ppm nitrate).This performance surpasses that of non-porous and less-defective CuO NWs and is attributed to the increased surface area and rapid electron transport facilitated by the distinctive morphology and generated *** calculation further suggests oxygen vacancies enhance NO_(3)^(-)adsorption on the sf-CuO NWs’surface and mitigate the competing hydrogen evolution *** study outlines a strategic design and simple synthesis approach for nanowire electrocatalysts that boost the efficiency of electrochemical nitrate-to-ammonia conversion.

关键词： CuO nanowires Solution-flame Mesoporous Oxygen vacancy Electrochemical nitrate reduction Wastewater

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Refining a Generic Force Field for Predicting Phase Transitions in Wine-Rack Metal-Organic Frameworks

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Journal of Chemical Theory and Computation 2025年第11期21卷 5599-5607页

作者： Kim, Dohoon Lim, Yunsung Kim, Jihan Department of Chemical and Biomolecular Engineering Korea Advanced Institute of Science and Technology Daejeon 34141 South Korea

Metal-organic frameworks (MOFs) are versatile materials with tunable properties, enabling their application in diverse fields. Flexible MOFs, characterized by their dynamic response to external stimuli, have gained significant attention for their gas storage and energy storage capabilities. However, predicting their flexibility, especially in wine-rack frameworks undergoing phase transitions, remains challenging. In this study, we developed a refined force field (UFF4WR-MOF) based on UFF4MOF to predict flexibility in wine-rack MOFs. We introduced key enhancements to accurately model metal coordination environments and π-π interactions, with a focus on MIL-53 and DMOF-1 frameworks as representative wine-rack MOFs. The UFF4WR-MOF showed superior performance compared to the UFF4MOF, achieving lower mean absolute errors (MAEs) in energy and volume predictions while accurately reproducing phase transitions relative to DFT results. Validation using experimentally synthesized MOFs confirmed its predictive accuracy and emphasized the importance of refining the force field to capture flexibility. Despite some limitations in systems with strong hydrogen bonding, the UFF4WR-MOF offers a robust and transferable tool for modeling flexibility in diverse wine-rack MOF structures. © 2025 American Chemical Society.

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Rationally designed graphene channels for real-time sodium ion detection for electronic tongue

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InfoMat 2023年第7期5卷 43-58页

作者： Chung Won Lee Sang Eon Jun Seung Ju Kim Tae Hyung Lee Sol A.Lee Jin Wook Yang Jin Hyuk Cho Shinyoung Choi Cheol-joo Kim Soo Young Kim Ho Won Jang Department of Materials Science and Engineering Research Institute of Advanced MaterialsSeoul National UniversitySeoulRepublic of Korea Department of Materials Science and Engineering Korea UniversitySeoulRepublic of Korea Department of Chemical Engineering Pohang University of Science and Technology(POSTECH)PohangRepublic of Korea Advanced Institute of Convergence Technology Seoul National UniversitySuwonRepublic of Korea

Monitoring taste-inducing ions and molecules continuously in liquids or solutions is of great considerable matter for the realization of the electronic tongue(E-tongue).Particularly from the five major tastes,the highly selective,sensitive detection of Na^(+)in real-time is *** is due to the saltiness of food is the key ingredient in most ***,existing Na^(+)detecting devices have relatively low performances of selectivity,sensitivity,and lack of on–off ***,conventional devices significantly deteriorate in capac-ity due to repetitive usage or lifetime shortage by degradation of the sensing ***,a graphene-based channel was rationally designed by the facile decoration of Calix[4]arene and Nafion to address this *** act as a receptor and a molecular sieve,respectively,to enhance selectivity and sensitivity and elon-gate the life expectancy of the *** device was merged with a microfluidic channel to control the injection and withdrawal of solutions to fulfill dynamic on–off *** fabricated device has highly selective,sensitive Na^(+)detection properties compared to other 10 molecule/ionic *** on–off functions of the device were available,also possesses a long lifespan of at least 220 ***,it can precisely discriminate real beverages containing Na^(+),which can be observed by principal component analysis *** features offer the possibility of ascending to a platform for E-tongues in near future.

关键词： electronic tongue graphene microfluidic channels Na^(+)sensors solution-gated field-effect transistors

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Arc plasma-deposited Co single-atom catalysts supported on an aligned carbon nanofiber for hydrogen peroxide electrosynthesis and an electro-Fenton process

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Carbon Energy 2024年第11期6卷 234-255页

作者： Chang‐Kyu Hwang Sooyeon Kim Ki Ro Yoon Thao Thi Le Chinh V.Hoang Jae Won Choi Wenjun Zhang Sae Yane Paek Chung Hyeon Lee Ji Hyun Lee Keun Hwa Chae Sohee Jeong Seung Yong Lee Byeong-Kwon Ju Sang Hoon Kim Sang Soo Han Jong Min Kim Materials Architecturing Research Center Korea Institute of Science and Technology (KIST))seculSecrngbuk-guRepublic of Korea Department of Micro/Nano Systems Korea UniversitySeoulSeongbuk-guRepublic of Korea Computational Science Research Center Korea Institute of Science and Technology (KIST)SeculSecrngbuk-guRepublic of Korea Advanced Textile R&D Department Korea Institute of Industrial Technology (KITECH)AmsanGyeonggi-doRepublic of Korea Extreme Materials Research Center Korea Institute of Science and Technology (KIST)SeoulSeongbuk:guRepubic of Korea Nanoscience and Technology KIST School University of Science and TechnologySeoulRepublic of Korea Advanced Analysis and Data Center Korea Institute of Science and TechnologySeoulSeongbuk-guRepublic of Korea Display and Nanosensor Laboratory School of Electrical Engineering Korea UniversitySeoulSeongbuk guRepublic of Korea KHU-KIST Department of Converging Science and Technology Kyung Hee UniversitySeoulSeongbuk-guRepubic of Korea

Atomically dispersed single-atom catalysts(SACs)on carbon supports show great promise for H_(2)O_(2) electrosynthesis,but conventional wet chemistry methods using particulate carbon blacks in powder form have limited their potential as two-electron(2^(e−))oxygen reduction reaction(ORR)***,we demonstrate high-performance Co SACs supported on a free-standing aligned carbon nanofiber(CNF)using electrospinning and arc plasma deposition(APD).Based on the surface oxidation treatment of aligned CNF and precise control of the deposition amount in a dry-based APD process,we successfully form densely populated Co SACs on aligned *** experimental analyses and density functional theory calculations,we reveal that Co SAC has a Co–N_(2)–O_(2) moiety with one epoxy group,leading to excellent 2^(e−)ORR ***,the aligned CNF significantly improves mass transfer in flow cells compared to randomly oriented CNF,showing an overpotential reduction of 30 mV and a 1.3-fold improvement(84.5%)in Faradaic efficiency,and finally achieves an outstanding production rate of 15.75 mol gcat^(−1) h^(−1) at 300 mA cm^(−2).The high-performance Co SAC supported on well-aligned CNF is also applied in an electro-Fenton process,demonstrating rapid removal of methylene blue and bisphenol F due to its exceptional 2e^(−)ORR activity.

关键词： arc plasma deposition electro-Fenton flow reactor hydrogen peroxide production oxygen reduction reaction single-atom catalysts

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Midcourse Trajectory Optimization for Variable-flow Ducted Rocket Missiles Based on Convex Optimization

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Journal of institute of Control, Robotics and Systems 2023年第8期29卷 652-661页

作者： Kim, Boseok Jung, Cheol-Goo Lee, Yongkun Sung, Hong-Gye Lee, Chang-Hun Department of Aerospace Engineering Korea Advanced Institute of Science and Technology Korea Republic of Department of Aerospace and Mechanical Engineering Korea Aerospace University Korea Republic of

This paper presents a convex optimization-based trajectory optimization method for variable-flow ducted rocket missiles during midcourse engagement to reach the predicted intercept point (PIP). The minimum-intercept time problem is established by reflecting the dynamics and some flight constraints for ducted rocket missiles. An artificial neural network (ANN) is utilized to approximate the nonlinear relationship between several flight conditions and the performance of ducted rockets. In addition, this study, unlike previous studies, proposes selecting the air-to-fuel ratio instead of the fuel mass-flow rate as a control input. This can alter the nonlinear constraint as an equivalent linear constraint by combining it with the pseudospectral method, which is demonstrated in this paper. A convex sub-problem is established by applying successive linearization to the nonlinear dynamic constraint. An improved trust-region algorithm is utilized with the convex sub-problem to solve the original non-convex problem. Numerical optimization results are provided to demonstrate the performance of the proposed method and investigate the optimal trajectory for variable-flow ducted rocket missiles. © ICROS 2023.

关键词： Neural networks

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Enhanced strength-ductility synergy in a gradient pseudo-precipitates heterostructured Al-2.5%Mg alloy:Design,fabrication,and deformation mechanism

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Journal of Materials science & technology 2024年第29期196卷 88-100页

作者： Renhao Wu Yeon Taek Choi Qingfeng Wu Xinxi Liu Dayong An Tianle Li Meng Li Hyoung Seop Kim Department of Plasticity Technology School of Materials Science&EngineeringShanghai Jiao Tong UniversityShanghai 200030China Graduate Institute of Ferrous&Eco Materials Technology Pohang University of Science and Technology37673South Korea Department of Materials Science and Engineering Pohang University of Science and Technology(POSTECH)37673South Korea School of Materials Science&Engineering Changsha University of Science&TechnologyChangsha 410114China Advanced Institute for Materials Research(WPI-AIMR) Tohoku UniversitySendai 980-8577Japan Institute for Convergence Research and Education in Advanced Technology Yonsei UniversitySeoul 03722South Korea

Heterostructures of alloyed composites,comprising heterogeneous domains with dramatically different constitutive properties,hold remarkable potential to expand the realm of material design systems and resolve the tradeoffbetween strength and *** study introduces an innovative materials design method for synthesizing gradient pseudo-precipitates heterostructure(GPHS)in non-heat-treatable Al-2.5%Mg *** cost-effective mild steel as both the diffusion source and protective layer,this heterostructure is achieved through pin-less friction stir-assisted cyclic localized deformation *** Fe atoms diffuse across the interface by friction stir-induced heat conduction,forming Fe-Al second-phase particles in the Al alloy matrix.A rapid inter-diffusion mechanism is activated in conjunction with dense dislocation walls,grain boundaries,and sub-structures,resulting in the formation of *** pseudo-precipitates are ultimately dispersed in a gradient distribution throughout the entire thickness of the Al alloy matrix induced by localized incremental *** GPHSed Al-2.5%Mg alloy exhibits an enhanced synergy of strength and ductility,with a uniform elongation increase from 11%to 21.2%,while maintaining the *** strengthening and hardening mechanisms,such as solid solution strengthening,dislocation hardening,and second phase strengthening,work synergistically to promote mechanical ***,the hetero-deformation between hard pseudo-precipitates and soft Al alloy matrix induces additional strain hardening,leading to high *** work provides a fresh perspective on the design and fabrication of high-performance alloys with advanced heterostructures,especially for non-heat-treatable alloys.

关键词： Gradient pseudo-precipitates heterostructure Enhanced strength-ductility synergy Rapid diffusion Hetero-deformation induced strain hardening Al-2.5%Mg alloy

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Unlocking Novel Functionality:Pseudocapacitive Sensing in MXene-Based Flexible Supercapacitors

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Nano-Micro Letters 2025年第4期17卷 212-229页

作者： Eunji Kim Seongbeen Kim Hyeong Min Jin Gyungtae Kim Hwi-Heon Ha Yunhui Choi Kyoungha Min Su-Ho Cho Hee Han Chi Won Ahn Jaewoo Roh Il-Kwon Oh Jinwoo Lee Yonghee Lee Department of Chemical and Biomolecular Engineering Korea Advanced Institute of Science and Technology(KAIST)291 Daehak-RoYuseong-GuDaejeon 34141Republic of Korea National Nano Fab Center(NNFC) 291 Daehak-RoYuseong-GuDaejeon 34141Republic of Korea Department of Organic Materials Engineering Chungnam National University99 Daehak-RoYuseong-GuDaejeon 34134Republic of Korea Department of Materials Science and Engineering Chungnam National University99 Daehak-RoYuseong-GuDaejeon 34134Republic of Korea Department of Nano&Advanced Materials Science and Engineering Kyungpook National University2559Gyeongsang-DaeroSangju-SiGyeongsangbuk-Do 37224Republic of Korea Department of Mechanical Engineering Korea Advanced Institute of Science and Technology(KAIST)291 Daehak-RoYuseong-GuDaejeon 34141Republic of Korea

Extensively explored for their distinctive pseudocapacitance characteristics,MXenes,a distinguished group of 2D materials,have led to remarkable achievements,particularly in the realm of energy storage *** work presents an innovative Pseudocapacitive *** key lies in switching the energy storage kinetics from pseudocapacitor to electrical double layer capacitor by employing the change of local pH(-log[H^(+)])in MXene-based flexible supercapacitors during *** sensing is observed in acidic electrolyte but absent in neutral *** shearing during bending causes liquid-crystalline MXene sheets to increase in their degree of anisotropic *** blocking of H+mobility due to the higher diffusion barrier,local pH *** electrochemical energy storage kinetics transits from Faradaic chemical protonation(intercalation)to non-Faradaic physical *** utilize the phenomenon of capacitance change due to shifting energy storage kinetics for strain sensing *** developed highly sensitive Pseudocapacitive Sensors feature a remarkable gauge factor(GF)of approximately 1200,far surpassing conventional strain sensors(GF:~1 for dielectric-cap sensor).The introduction of the Pseudocapacitive Sensor represents a paradigm shift,expanding the application of pseudocapacitance from being solely confined to energy devices to the realm of multifunctional *** technological leap enriches our understanding of the pseudocapacitance mechanism of MXenes,and will drive innovation in cutting-edge technology areas,including advanced robotics,implantable biomedical devices,and health monitoring systems.

关键词： MXenes Supercapacitors Pseudocapacitive sensing Local pH Operando measurements

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