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Cubic S/N co-doped TiO_(2) with rich oxygen vacancies from Ti-MOFs for efficient elimination of formaldehyde

Chinese Chemical Letters 2024年第2期35卷 512-515页

作者： Qing Gao Lei Sun Zhihua Wang Jiguang Deng State Key Laboratory of Chemical Resource Engineering Beijing University of Chemical TechnologyBeijing 100029China Beijing Key Laboratory for Green Catalysis and Separation Key Laboratory of Beijing on Regional Air Pollution ControlKey Laboratory of Advanced Functional MaterialsEducation Ministry of ChinaDepartment of Chemical EngineeringBeijing University of TechnologyBeijing 100124China

The cubic S/N co-doped TiO_(2)(TNSx,x is the calcination temperature)photocatalysts with rich oxygen vacancies were obtained by high temperature calcination of sulfur powder and titanium-based MOFs NH_(2)-MIL-125 for the photocatalytic removal of gaseous formaldehyde(a volatile organic compound).Among the obtained catalysts,the presence of oxygen vacancies restricted photogenerated electron and holes recombination.98.00%removal of gaseous formaldehyde in 150 min could be achieved over TNS600 by xenon *** removal efficiency for formaldehyde was well retained for five cycle *** results from PL,TRPL and EIS revealed that TNS600 had the best separation efficiency of photogenerated electrons and holes,and the enhanced charge separation led to a significant increase in photocatalytic *** photocatalytic oxidation mechanism indicated that the ^(•)OH and ^(•)O_(2)−radicals were mainly involved in the efficient elimination of gaseous formaldehyde and were able to mineralize formaldehyde to H_(2)O and CO_(2).

关键词： Metal-organic frameworks Photocatalysis Formaldehyde removal S/N co-doped TiO_(2) Oxygen vacancies

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Defect chemistry and thermal conductivity of the εSmO_(1.5)·(1−ε)ZrO_(2)(0.2≤ε≤0.65)ceramics:Effect of the nonstoichiometry

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Journal of advanced Ceramics 2024年第11期13卷 1823-1834页

作者： Zhixue Qu Tong Zhang Wei Pan Key Laboratory of Advanced Functional Materials Education Ministry of ChinaCollege of Materials Science and EngineeringBeijing University of TechnologyBeijing 100124China State Key Laboratory of New Ceramics and Fine Processing School of Materials Science and EngineeringTsinghua UniversityBeijing 100084China

Rare-earth zirconate pyrochlores,which exhibit various interesting properties,especially low thermal conductivity,are of great *** is an effective strategy involving defect engineering to reduce the thermal conductivity of *** this work,a long series of solid solutions,εSmO_(1.5)·(1−ε)ZrO_(2)(ε=0.200,0.250,0.350,0.400,0.450,0.500,0.525,0.550,0.600,and 0.650),were designed and synthesized to investigate the effects of nonstoichiometry on the structural evolution,defect chemistry,and thermal conductivity of SmO_(1.5)–ZrO_(2) system across the entire pyrochlore phase field and phase transition *** similarity of all the Raman spectra provides an incredible opportunity to confirm the structural details and evolution of pyrochlore and defective fluorite,as well as the emergence of the expected point defects.A new solution mechanism concerning nonstoichiometry was proposed and confirmed by analyzing the variations in the experimental density and Raman *** thermal conductivities of all the samples were measured,and investigated in terms of the phonon-scattering *** results show that the nonstoichiometry with SmO1.5 excess is more effective in reducing the thermal conductivity to an extremely low value of approximately 1 W/(m·K),which can be attributed to the dramatic decrease in the average acoustic velocity in addition to the strong phonon scattering of Zr ion vacancies and oxygen *** the other hand,the nonstoichiometry with ZrO_(2) excess significantly reduces the thermal conductivity at room temperature,but conversely leads to a slight increase of it above 200°*** former variation can be attributed to the phonon scattering of the 8a interstitial oxygen ions,which has a similar effectiveness to the defects on the SmO1.5-rich *** latter variation may be attributed to the Umklapp scattering of phonons.

关键词： nonstoichiometry pyrochlore rare-earth zirconate thermal conductivity defect chemistry

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Hot deformation behavior and microstructure evolution of GH3536-TiB_(2) composites fabricated by powder metallurgy

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Science China(Technological Sciences) 2024年第7期67卷 2107-2124页

作者： ZHOU ShiPeng WANG Shuai HUANG LuJun ZHANG Rui CHEN Xin MENG FanChao CHEN Run SUN FengBo WANG CunYu GENG Lin School of Materials Science and Engineering Harbin Institute of TechnologyHarbin 150001China Waikato Centre for Advanced Materials and Manufacturing School of EngineeringUniversity of WaikatoHamilton 3240New Zealand State Key Laboratory of Advanced Welding and Joining Harbin Institute of TechnologyHarbin 150001China

The hot deformation behavior and microstructure evolution of GH3536-TiB2composites fabricated by powder metallurgy(PM)were examined in the temperature range of 950–1150℃ and strain rate range of 0.001–1 s^(-1). The hot compression stress-strain curves and the constitutive equation were obtained. In addition, the hot processing map was drawn, which indicated that the appropriate hot working window was 950–1050℃/0.001–0.1 s^(-1)and 1050–1100℃/0.001–0.01 s^(-1). The microstructure analysis showed that the splitting and spheroidization of M3B2led to a decrease in size and volume fraction at 950–1100℃. At 1150℃,the eutectic microstructure of M_(3)B_(2)+ γ was formed due to the dissolution of M_(3)B_(2), which caused macroscopic cracking of the deformed sample. Additionally, the deformation temperature and the strain rate had little effect on the size and volume fraction of M_(3)B_(2). Besides, discontinuous dynamic recrystallization(DDRX) and continuous dynamic recrystallization(CDRX) were found in the deformed microstructure, while the former was dominant. Within the test range of this work, the dynamic recrystallization(DRX) fraction of the deformed composites was high due to the bulging nucleation of numerous interfaces. The DRX grain size increased with increasing deformation temperature or decreasing strain rate. Texture analysis showed that the deformation texture of <101>//compression direction RD existed in the matrix when the deformation temperature was below 1100℃, and the texture type became <001>//RD at 1100℃. Additionally, it was also found that the <001>//RD texture was formed in M3B2under the strain rates of 0.1 and 0.01 s^(-1).

关键词： GH3536 alloy matrix composites powder metallurgy hot deformation behavior microstructure evolution

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Switching Reaction Pathway of Medium-Concentration Ether Electrolytes to Achieve 4.5 V Lithium Metal Batteries (vol 23, pg 8481, 2023)

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NANO LETTERS 2023年第21期23卷 10097-10097页

作者： Jiang, Zhipeng Deng, Yu Mo, Jisheng Zhang, Qingan Zeng, Ziqi Li, Yongtao Xie, Jia School of Materials Science and Engineering Key Laboratory of Green Fabrication and Surface Technology of Advanced Metal Materials of Ministry of Education Anhui University of Technology Maanshan 243002 China State Key Laboratory of Advanced Electromagnetic Engineering and Technology School of Electrical and Electronic Engineering Huazhong University of Science and Technology Wuhan 430074 China

Pursuing high-energy-density lithium metal batteries (LMBs) necessitates the advancement of electrolytes. Despite demonstrating high compatibility with lithium metal anodes (LMAs), ether-based electrolytes face challenges in achieving stable cycling at high voltages. Herein, we propose a strategy to enhance the high-voltage stability of medium-concentration (∼1 M) ether electrolytes by altering the reaction pathway of ether solvents. By employing a 1 M lithium difluoro(oxalato)borate in dimethoxyethane (LiDFOB/DME) electrolyte, we observed that LiDFOB displays a pronounced tendency for decomposition over DME, leading to a modification in the decomposition pathway of DME. This modification facilitates the formation of a stable organic–inorganic hybrid interface. Utilizing such an electrolyte, the Li-LCO cell demonstrates a discharge specific capacity of 146 mAh g–1 (5 C) and maintains retention of 86% over 1000 cycles at 2 C under a 4.5 V cutoff voltage. Additionally, the optimized ether electrolyte demonstrated outstanding cycling performance in Li-LCO full cells under practical conditions.

关键词： lithium metal battery electrolyte high-voltage ether interface

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Recent progress and perspective on lithium metal battery with nickel-rich layered oxide cathode

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eScience 2024年第6期4卷 75-87页

作者： Han Zhang Ziqi Zeng Shijie Cheng Jia Xie State Key Laboratory of Advanced Electromagnetic Technology School of Electrical and Electronic EngineeringHuazhong University of Science and TechnologyWuhan 430074China State Key Laboratory of Materials Processing and Die&Mould Technology School of Materials Science and EngineeringHuazhong University of Science and TechnologyWuhan 430074China

The pairing of lithium metal anode(LMA)with Ni-rich layered oxide cathodes for constructing lithium metal batteries(LMBs)to achieve energy density over 500 Wh kg^(-1) receives significant attention from both industry and the scientific ***,notorious problems are exposed in practical conditions,including lean electrolyte/capacity(E/C)ratio(<3 g(Ah)^(-1)),high cathode mass loading(>3 mAh cm^(-2)),and low negative/positive(N/P)ratio(<3),which creates a significant disparity between the current performance of LMBs and the desired requirements for commercial *** the review,we present a summary of the recent achievements made in understanding the mechanistic degradation of LMA,followed by practical strategies that are utilized to address these *** also consider the detrimental issues of Ni-rich layered oxide ***,we highlight current progresses in the field of practical LMBs in coin/pouch cells to stimulate further *** the end,we propose the issues and prospects for development from the perspective of practical LMBs.

关键词： Lithium metal anode Ni-rich layered oxide cathodes Lithium metal batteries Practical conditions Cyclic performance High energy density

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Three-dimensional fracture of UO_(2)ceramic pellets by phase field modeling

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Science China(Physics,Mechanics & Astronomy) 2025年第1期68卷 165-176页

作者： Wei Xiong Xuan Ye Hongzhang Cheng Xiaoming Liu Institute of Nuclear and New Energy Technology Collaborative Innovation Center of Advanced Nuclear Energy TechnologyKey Laboratory of Advanced Reactor Engineering and Safety of Ministry of EducationTsinghua UniversityBeijing 100084China State Key Laboratory of Nonlinear Mechanics Institute of MechanicsChinese Academy of SciencesBeijing 100190China School of Engineering Science University of Chinese Academy of SciencesBeijing 100049China

Fracture is the primary failure type for the UO_(2)ceramic pellets,which are operated under irradiation and thermal processes,and physically confined by the *** this work,by combining closely coupled physical processes of heat conduction,heat transfer,and mechanical deformation with the cohesive phase field framework,we proposed a high-precision modeling of quasistatic cracking of three-dimensional(3D)UO_(2)ceramic fuel pellets under high temperature and *** simulation results agree well with the experimental results,indicating that the proposed method has the potential to capture 3D crack modes in the interested time ***,we studied the relation of the 3D fracture patterns of fuel pellets with the peak power *** was found that the power level plays a critical role in determining the competition between radial and circumferential cracks,as well as transverse penetrating cracks.

关键词： phase field method nuclear fuel pellet coupled thermo-mechanical model thermal fracture

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Critical precipitation behavior of MnTe inclusions in resulfurized steels during solidification

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International Journal of Minerals,Metallurgy and Materials 2024年第8期31卷 1849-1857页

作者： Xiangyu Xu Lu Zhang Zifei Wang Qianren Tian Jianxun Fu Xuemin Wang Center for Advanced Solidification Technology(CAST) School of Materials Science and EngineeringShanghai UniversityShanghai 200444China State Key Laboratory of Advanced Special Steel Shanghai UniversityShanghai 200444China Collaborative Innovation Center of Steel Technology University of Science and Technology BeijingBeijing 100083China Yangjiang Branch Guangdong Laboratory for Materials Science and Technology(Yangjiang)Advanced Alloys LaboratoryYangjiang 529500China

Te treatment is an effective method for modifying sulfide inclusions,and MnTe precipitation has an important effect on thermal brittleness and steel corrosion *** most actual industrial applications of Te treatment,MnTe precipitation is *** critical precipitation behavior of MnTe inclusions was investigated through scanning electron microscopy,transmission electron microscopy,machine learning,and first-principles *** preferentially precipitated at the container mouth for sphere-like sulfides and at the interface between MnS grain boundaries and steel matrix for rod-like *** MnS/MnTe interface was semicoherent.A composition transition zone with a rock-salt structure exhibiting periodic changes existed to maintain the semicoherent *** critical precipitation behavior of MnTe inclusions in resulfurized steels involved three stages at varying ***,Mn(S,Te)precipitated during ***,MnTe with a rock-salt structure precipitated from Mn(S,Te).Third,MnTe with a hexagonal NiAs structure transformed from the rock-salt *** solubility of Te in MnS decreased with decreasing *** critical precipitation behavior of MnTe inclusions in resulfurized steels was related to the MnS precipitation *** the increase in MnS precipitation temperature,the critical Te/S weight ratio *** consideration of the cost-effectiveness of Te addition for industrial production,the Te content in resulfurized steels should be controlled in accordance with MnS precipitation temperature and S content.

关键词： resulfurized steels modification of inclusion manganese telluride precipitation

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Carbon-based functional materials for atmospheric water utilization

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Nano Research 2023年第11期16卷 12491-12505页

作者： Wenya He Tengyu Lin Huhu Cheng Liangti Qu Laboratory of Flexible Electronics Technology Key Laboratory of Organic Optoelectronics&Molecular EngineeringMinistry of EducationDepartment of ChemistryState Key Laboratory of Tribology in Advanced Equipment(SKLT)Tsinghua UniversityBeijing 100084China

Atmospheric water,as one of the most abundant natural resources on Earth,has attracted huge research interest in the field of water harvesting and energy harvesting and conversion owing its environmental friendliness and easy *** developments of new materials have seen advanced technologies that can extract water and energy out of this long-neglected resource,suggesting a promising and sustainable approach to address the water and energy crises over the ***-based functional materials have been considered to be indispensable materials for atmospheric water utilization due to their large surface area,excellent adsorption performance,and higher surface *** this review,first,we analyze the interaction between carbon-based functional materials and atmospheric water ***,technologies developed in recent years for atmospheric water utilization based on carbon-based functional materials are reviewed,mainly focusing on atmospheric water harvesting,moisture-enabled electricity generation,and moisture-responsive ***,the remaining challenges and some tentative suggestions possibly guiding developments are proposed,which may pave a way for a bright future of carbon-based functional material in the utilization of atmospheric water.

关键词： carbon-based functional material atmospheric water atmospheric water harvesting moisture-enabled power generator moisture actuators

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Sulfate-assisted Ni/Fe-based electrodes for anion exchange membrane saline splitting

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Nano Research 2024年第7期17卷 5985-5995页

作者： Yujun Han Li Shao Yuhang Liu Guodong Li Tongzhou Wang Xuerong Zheng Jihong Li Xiaopeng Han Wenbin Hu Yida Deng School of Materials Science and Engineering Key Laboratory of Advanced Ceramics and Machining Technology of Ministry of EducationTianjin UniversityTianjin 300072China State Key Laboratory of Marine Resource Utilization in South China Sea School of Materials Science and EngineeringHainan UniversityHaikou 570228China State Key Laboratory of Inorganic Synthesis and Preparative Chemistry College of ChemistryJilin UniversityChangchun 130012China Key Laboratory of Advanced Energy Materials Chemistry(Ministry of Education) Nankai UniversityTianjin 300071China

Saline water electrolysis is an appealing strategy for hydrogen production,attracting more attention in recent ***-based electrodes exhibit promise as catalysts for saline water ***,they suffer from the inferior service life of the oxygen evolution reaction(OER).Herein,we report an oxygen-evolution electrode consisting of a sulfate-modulated nickel-iron hydroxide(NiFeOOH)affording as the catalytic active layer and Fe-Ni_(3)S_(2) as the corrosion-proof *** developed electrode only requires overpotentials of 220 and 292 mV to deliver the current density of 10 and 500 mA·cm^(−2),*** importantly,it presents long-term stability exceeding 140 and 100 h in 1 M KOH at high current densities of 500 and 1000 mA·cm^(−2),respectively,as well as 120 h for saline water electrolysis at 100 mA·cm^(−2).Experimental results reveal that the generated sulfate plays an indispensable role in improving stability and corrosion *** assembled and tested an anion exchange membrane electrolyzer with Pt/C and NiFeS/NIF as the cathode and anode,respectively,under industrial *** overall water-splitting electrolyzer achieves an impressive energy conversion efficiency of 75%±0.5%.This report offers fresh insights into the design of stable NiFe-based electrodes,which may further promote its practical applications for saline water electrolysis.

关键词： saline water electrolysis oxygen evolution reaction anode material water splitting

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A novel triple periodic minimal surface-like plate lattice and its data-driven optimization method for superior mechanical properties

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Applied Mathematics and Mechanics(English Edition) 2024年第2期45卷 217-238页

作者： Yanda WANG Yanping LIAN Zhidong WANG Chunpeng WANG Daining FANG State Key Laboratory for Turbulence and Complex Systems&Center for Applied Physics and Technology College of EngineeringPeking UniversityBeijing 100871China Institute of Advanced Structure Technology Beijing Institute of TechnologyBeijing 100081China

Lattice structures can be designed to achieve unique mechanical properties and have attracted increasing attention for applications in high-end industrial equipment,along with the advances in additive manufacturing(AM)*** this work,a novel design of plate lattice structures described by a parametric model is proposed to enrich the design space of plate lattice structures with high connectivity suitable for AM *** parametric model takes the basic unit of the triple periodic minimal surface(TPMS)lattice as a skeleton and adopts a set of generation parameters to determine the plate lattice structure with different topologies,which takes the advantages of both plate lattices for superior specific mechanical properties and TPMS lattices for high connectivity,and therefore is referred to as a TPMS-like plate lattice(TLPL).Furthermore,a data-driven shape optimization method is proposed to optimize the TLPL structure for maximum mechanical properties with or without the isotropic *** this method,the genetic algorithm for the optimization is utilized for global search capability,and an artificial neural network(ANN)model for individual fitness estimation is integrated for high efficiency.A set of optimized TLPLs at different relative densities are experimentally validated by the selective laser melting(SLM)fabricated *** is confirmed that the optimized TLPLs could achieve elastic isotropy and have superior stiffness over other isotropic lattice structures.

关键词： lattice structure triple periodic minimal surface(TPMS) plate lattice structural optimization machine learning

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