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Modulation of d-orbital to realize enriched electronic cobalt sites in cobalt sulfide for enhanced hydrogen evolution in electrocatalytic water/seawater splitting

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Rare Metals 2024年第2期43卷 511-521页

作者： Jian-peng Sun Yu Zheng zi-Sheng Zhang Xiang-Chao Meng zi-Zhen Li Key Laboratory of Marine Chemistry Theory and Technology(Ministry of Education) College of Chemistry and Chemical EngineeringOcean University of ChinaQingdao266100China Shanxi Institute of Energy Taiyuan030600China Department of Chemical and Biological Engineering Faculty of EngineeringUniversity of OttawaOttawaONK1N6 N5Canada

Herein,a novel single-atomic Pt doping and interface-rich CoS/Co(OH)_(2)(Pt-CoS/Co(OH)_(2)/C)electrocatalyst has been successfully *** from precise regulation of d-orbital electronic structure modulation on Co site,Pt-CoS/Co(OH)_(2)/C exhibited remarkable HER activity and high stability for hydrogen evolution in splitting both water(73 mV@10 mA·cm^(−2)) and seawater(87 mV@10 mA·cm^(−2)).Notably,atomic Pt doping was introduced into CoS/Co(OH)_(2),which could produce local unbalanced Coulombic force and significantly increased the number of S vacancies,and then expose abundant Co ***,Co(OH)_(2) in Pt-CoS/Co(OH)_(2)/C could act as the adsorption sites for H_(2)O in hydrogen evolution reaction *** functional theory results also proved that atomic Pt doping,S vacancies and Co(OH)_(2) coupling could result in the formation of enriched electronic Co sites and optimize d_(z2) orbital electronic structure,and then realize the depth upward shift of d-band center and enhance the adsorption of H*on Co sites.

关键词： Electrocatalysts Hydrogen evolution reaction Pt-CoS/Co(OH)_(2) d-band center Electronic structure Water/seawater electrolysis

Realizing high initial Coulombic efficiency in manganese-based layered oxide cathodes for sodium-ion batteries via P2/O'3 biphasic structure optimization

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Rare Metals 2024年第5期43卷 2093-2102页

作者： Bo peng zi-Hao Zhou Ping Xuan Jie Xu Lian-Bo Ma School of Materials Science and Engineering Anhui University ofTechnologyMa'anshan 243002China Anhui Product Quality Supervision&Inspection Research Institute Hefei 230051China

Mn-based layered oxides are among the most promising cathode materials for sodium-ion batteries owing to the advantages of abundance,environmenta friendliness,low cost and high specific capacity.P2 and O'3 are two representative structures of Mn-based layered ***,the P2 structure containing insufficien Na generally exhibits low initial charge capacity,while O'3structure with sufficient Na delivers high initial charge capacity but poor cycle *** study prepared a multitude of Na_(x)MnO_(2)(x=0.7,0.8,0.9)cathode materials with varying P2/O'3 ratios and further investigated their electrochemical *** optimized Na_(0.8)MnO_(2) comprising 69.9 wt%O'3 and 30.1 wt%P2 phase,exhibited relatively balanced specific capacity,Coulombic efficiency and cycle ***,it achieved a high specific capacity of 128.9 mAh·g^(-1) with an initia Coulombic efficiency of 98.2%in half-cell configuration The Na_(0.8)MnO_(2)//hard carbon full cell also achieved a high specific capacity of 126.7 mAh·g^(-1) with an initia Coulombic efficiency of 98.9%.Moreover,the capacity fading mechanism was revealed by combining in-situ and ex-situ X-ray *** findings of this study provide theoretical guidance for further modification design of Mnbased layered cathodes.

关键词： Sodium-ion batteries Cathode materials Mn-based layered oxides P2/0'3 composites

Photocaged activity-based probes for improved monitoring of protein S-sulfenylation in living cells

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Chinese Chemical Letters 2024年第2期35卷 451-454页

作者： Jiahao Zhang Haiyue peng zi'an Chen Guorui Li Jing Huang State Key Laboratory of Chemo/Biosensing and Chemometrics Hunan Provincial Key Laboratory of Animal Models and Molecular MedicineSchool of Biomedical SciencesHunan UniversityChangsha 410082China

Protein S-sulfenylation(protein sulfenic acid),as one of the most significant oxidative post-translational modifications(OxiPTMs),plays a vital role in regulating protein function.A variety of activity-based probes have been developed to profile sulfenic acid in living ***,due to the transient presence and low content of sulfenic acid in living cell,high doses of probes are needed to achieve efficient *** importantly,current probes have no temporal control over sulfenic acid *** overcome these limitations,two caged cysteine sulfenic acid probes DYn-2-ONB and DYn-2-Cou with either an o-nitrobenzyl or coumarin protecting group were developed in this *** probes can be efficiently uncaged via irradiation to produce the active C-nucleophile probe *** assay in living cells demonstrated DYn-2-ONB exhibited better labeling capacity compared with DYn-2,providing it as a powerful tool for improved monitoring of protein S-sulfenylation in living cells.

关键词： Cysteine Sulfenic acid Activity-based probe Photocage Light activation Protein S-sulfenylation

Interface strengthening for thermal sprayed WC-10Co4Cr coating subjected to pulsed magnetic treatment

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Rare Metals 2024年第2期43卷 780-795页

作者： Cheng-Kai Qian Qu Liu heng Wang Ke-Jian Li Zhi-peng Cai Department of Mechanical Engineering Tsinghua UniversityBeijing100084China Tianjin Research Institute for Advanced Equipment Tsinghua UniversityTianjin300304China State Key Laboratory of Tribology in Advanced Equipment Tsinghua UniversityBeijing100084China

The reliability of the coated industry components demands ideal fatigue properties of the coating,and it is mainly determined by the performance of the *** this study,pulsed magnetic treatment(PMT)was applied to the thermal sprayed WC-10Co4Cr coating,and the fatigue lifetime of the coated bolt increased by 219.82%under an imitation of the operating mode *** tests further proved that both the adhesion and cohesion strength were improved after PMT,and they benefit from the interface strengthening *** formation of coherent WC/Co interfaces was characterized by in-situ transmission electron microscopy(TEM),and the molecular dynamic simulations indicate that the work of separation of these interfaces is much higher than the original disordered *** stress was relaxed and distributed more homogeneously after PMT,and it mainly contributes to the coating/substrate *** work provides a new post-treatment method focusing on the interfaces in the WC-based coating and gives insight into its mechanism so that it is hopeful to be applied to other kinds of coatings.

关键词： Cemented carbide coating Pulsed magnetic treatment Interface strengthening Fatigue properties Adhesion strength

Optimized Auxiliary Frequency Control of Wind Farm Based on Piecewise Reduced-order Frequency Response Model

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Journal of Modern Power Systems and Clean Energy 2024年第3期12卷 791-802页

作者： Xu Zhang Chen Zhao Junchao Ma Long Zhang Dan Sun Chenxu Wang Yan peng heng Nian the School of Electrical Engineering Zhejiang UniversityHangzhou 310058China Electric Power Research Institute of State Grid Zhejiang Electric Power Corporation Hangzhou 310014China

With the increasing wind power penetration in the power system,the auxiliary frequency control(AFC)of wind farm(WF)has been widely *** traditional system frequency response(SFR)model is not suitable for the wind power generation system due to its poor accuracy and *** this paper,a piecewise reduced-order frequency response(PROFR)model is proposed,and an optimized auxiliary frequency control(O-AFC)scheme of WF based on the P-ROFR model is ***,a full-order frequency response model considering the change in operating point of wind turbine is established to improve the *** order to simplify the fullorder model,a P-ROFR model with second-order structure and high accuracy at each frequency response stage is *** on the proposed P-ROFR model,the relationship between the frequency response indexes and the auxiliary frequency controller coefficients is expressed ***,an OAFC scheme with the derived explicit expression as the optimization objective is proposed in order to improve the frequency support capability on the premise of ensuring the full release of the rotor kinetic energy and the full use of the effect of time delay on frequency ***,the effectiveness of the proposed P-ROFR model and the performance of the proposed OAFC scheme are verified by simulation studies.

关键词： Frequency response piecewise reduced-order wind farm auxiliary frequency control

Delayed-measurement one-way quantum computing on cloud quantum computer

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Chinese Physics B 2024年第9期33卷 125-131页

作者： Zhi-peng Yang Yu-Ran Zhang Fu-Li Li heng Fan Beijing Academy of Quantum Information Science Beijing 100193China Ministry of Education Key Laboratory for Nonequilibrium Synthesis and Modulation of Condensed Matter Shaanxi Province Key Laboratory of Quantum Information and Quantum Optoelectronic DevicesSchool of PhysicsXi’an Jiaotong UniversityXi’anShaanxi 710049China School of Physics and Optoelectronics South China University of TechnologyGuangzhou 510640China Institute of Physics China Academy of SciencesBeijing 100190China

One-way quantum computation focuses on initially generating an entangled cluster state followed by a sequence of measurements with classical communication of their individual ***,a delayed-measurement approach has been applied to replace classical communication of individual measurement *** this work,by considering the delayed-measurement approach,we demonstrate a modified one-way CNOT gate using the on-cloud superconducting quantum computing platform:*** modified protocol for one-way quantum computing requires only three qubits rather than the four used in the standard *** this modified cluster state decreases the number of physical qubits required to implement one-way computation,both the scalability and complexity of the computing process are *** to previous work,this modified one-way CNOT gate is superior to the standard one in both fidelity and resource *** have also numerically compared the behavior of standard and modified methods in large-scale one-way quantum *** results suggest that in a noisy intermediate-scale quantum(NISQ)era,the modified method shows a significant advantage for one-way quantum computation.

关键词： measurement-based quantum computing quantum entanglement quantum gates

Reduced Spring Precipitation Bias and Associated Physical Causes over South China in FGOALS-f3 Climate Models:Experiments with the Horizontal Resolutions

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Journal of Meteorological Research 2024年第4期38卷 784-804页

作者： peng zi Yimin LIU Jiandong LI Ruowen YANG Bian HE Qing BAO Department of Atmospheric Science Yunnan UniversityKunming 650504 State Key Laboratory of Numerical Modeling for Atmospheric Sciences and Geophysical Fluid Dynamics(LASG) Institute of Atmospheric PhysicsChinese Academy of SciencesBeijing 100029

Considerable spring precipitation occurs over South China(SC),a region that is adjacent to large-scale Asian topography and *** reasonable simulation is crucial for improving regional climate *** study investigates spring precipitation biases over SC and their possible causes in atmosphere-only and coupled Flexible Global Ocean–Atmosphere–Land System finite-volume version 3(FGOALS-f3) models with different horizontal *** performance of spring precipitation simulation over SC varies across different FGOALS-f3 model versions,with the best reproducibility in the high-resolution coupled model(25 km).In the low-resolution atmosphere-only model(100–125 km),the precipitation dry bias over SC is closely linked to overestimated surface sensible forcing over the eastern Tibetan Plateau(TP),which weakens the subtropical anticyclone over the western Pacific(SAWP) through regional circulation *** contrast,the high-resolution atmosphere-only model further amplifies surface thermal forcing in the Asian continents,causing intensified land–sea thermal contrast between the Southeast Asian continents and western Pacific,enhanced southerly winds and SAWP,and increased water vapor transport into ***,the reduced middle–high level cold bias over 10°–30°N in the high-resolution atmosphere-only model intensifies the East Asian westerly jet and ascent over SC,leading to enhanced spring precipitation *** high-resolution coupled model simulation not only reduces sea surface cold bias over the Bay of Bengal,thus intensifying the Indian–Burma trough and strengthening low-level water vapor transport into SC,but also enhances ascent over *** a result,the high-resolution coupled model better reproduces the magnitude and pattern of spring precipitation over SC than its atmosphere-only *** with low-resolution models,the domain-mean spring precipitation dry bias decreases by 11.2% over SC in the high-resolution atmosphere-only mod

关键词： South China spring precipitation high resolution Flexible Global Ocean–Atmosphere–Land System finite-volume version 3(FGOALS-f3)models simulation

Correlation between longitudinal crack occurrence and mold heat transfer in continuous casting based on process data mining

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Journal of Iron and Steel Research International 2024年第5期31卷 1139-1152页

作者： Zhi-qiang peng zi-bing Hou Kai Yi Kun-hui Guo Dong-wei Guo Guang-hua Wen College of Materials Science and Engineering Chongqing UniversityChongqing400044China Chongqing Key Laboratory of Vanadium-Titanium Metallurgy and New Materials Chongqing UniversityChongqing400044China

The correlation between the longitudinal crack occurrence and integrated heat transfer of the mold with data mining methods was ***,three kinds of support vector machine models based on principal component analysis with different input features were established to explore the effect of integrated heat transfer on the accuracy of the prediction model for the longitudinal *** results show that the accuracy was improved while features including mean and standard deviation of integrated heat transfer were ***,the difference in integrated heat transfer between defect and normal samples under the same process parameters was quantitatively *** with normal samples,the temperature difference of cooling water for defect samples decreased by 0.65%,and the temperature difference fluctuation increased by 31.1%.Finally,the literature data were used to provide support for the quantitative correlation according to defect formation mechanism.A new criterion for the prediction of longitudinal crack and a discovering method for correlation between product quality and process parameters in the manufacturing industry have been provided.

关键词： Continuous casting slab Longitudinal surface crack Heat transfer Data mining Quantitative correlation

Modeling of LF refining process:a review

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Journal of Iron and Steel Research International 2024年第2期31卷 289-317页

作者： zi-cheng Xin Jiang-shan Zhang Kai-xiang peng Jun-guo Zhang Chun-hui Zhang Qing Liu State Key Laboratory of Advanced Metallurgy University of Science and Technology BeijingBeijing100083China School of Automation and Electrical Engineering University of Science and Technology BeijingBeijing100083China Tangshan Branch Hebei Iron and Steel Co.Ltd.Tangshan063000HebeiChina Xinjiang Bayi Iron and Steel Co. Ltd.Baosteel GroupWulumuqi830022XinjiangChina

With the increasing demand for energy conservation and emission reduction,more attentions have been paid to the intelligentization,greenization and low carbonization during the transformation and upgrading of steelmaking *** furnace(LF)refining is one of the key procedures in steelmaking process and has been widely used in steelmaking plants for its high equipment matching degree,low equipment investment and outstanding refining *** to the main tasks of LF refining process,the modeling methods of temperature prediction model,slag-making model,alloying model,argon blowing model and model of inclusions behavior were systematically reviewed,and the advantages and disadvantages of each modeling method were *** addition,the technical framework for the future has also been proposed based on existing works,including classification of raw materials,graphic representation of knowledge,introduction,upgradation and management of device/equipment,customization of steelmaking,modeling of refining process,synergy of models,intelligentization of decision-making,automation of control,and digitization of processes and operations,aiming to provide a reference for the modeling and intelligent development of LF refining process.

关键词： LF refining Temperature prediction Slag-making Alloying Argon blowing Inclusion behavior Modeling method