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Triangular Halogen Bond and Hydrogen Bond Supramolecular Complex Consisting of Carbon Tetrabromide, Halide, and Solvent Molecule： A Theoretical and Spectroscopic Study

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Chinese Journal of Chemical Physics 2014年第3期27卷 265-273页

作者： Yu-jie Wu xiao-ran zhao Hai-yue Gao Wei-jun Jin College of Chemistry Beijing Normal University Beijing 100875 China

The theoretical calculation and spectroscopic experiments indicate a kind of triangular three bonding supramolecular complexes CBr4…X^-…-H-C, which consist of carbon tetrabromide, halide, and protic solvent molecule （referring to dichloromethane, chloroform and acetonitrile）, can be formed in solution. The strength of halogen and hydrogen bonds in the triangular complexes using halide as common acceptor obeys the order of iodide〉bromide〉chloride. The halogen and hydrogen bonds work weak-cooperatively. Charge transfer bands of halogen bonding complexes between CBra and halide are observed in UV-Vis absorption spectroscopy in three solvents, and then the stoichiometry of 1：1, formation constants K and molar extinction coefficients ε of the halogen bonding complexes are obtained by Benesi-Hildebrand method. The K and ε show a dependence on the solvent dielectric constant and, on the whole, obey an order of iodide〉bromide〉chloride in the same solvents. Furthermore, the C-H vibrational frequencies of solvent molecules vary obviously with the addition of halide, which indicates the C-H…X- interaction. The experimental data indicate that the halogen bond and hydrogen bond coexist by sharing a common halide acceptor as predicted by calculation.

关键词： Halogen bond Hydrogen bond Halide Carbon tetrabromide Charge transfer

Superhydrophilic nickel hydroxide ultrathin nanosheets enable high-performance asymmetric supercapacitors

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Rare Metals 2024年第1期43卷 138-147页

作者： Yi-ran Wang Fei Zhang Jian-Min Gu xiao-Yu zhao ran zhao Xing Wang Tian-Hui Wu Jing Wang Ji-Dong Wang De-Song Wang State Key Laboratory of Metastable Materials Science and Technology(MMST) Hebei Key Laboratory of Applied ChemistryYanshan UniversityQinhuangdao 066004China Department of Food and Pharmaceutical Engineering Suihua UniversitySuihua 152000China School of Chemical Science and Engineering Tongji UniversityShanghai 200092China School of Sciences Hebei University of Science and TechnologyShijiazhuang 050018China

Superhydrophilic surfaces have been applied for supercapacitor;however,during energy storage reaction,how the wettability affects the process of electrochemical reaction specifically is still ***,we demonstrate superhydrophilic surface for promotion of electrochemical reactions by liquid affinity and further explain the mechanism,where the transition of the wettability state caused by the change in surface free energy is the main reason for the obvious increase in specific *** citric acid assistance strategy,an intrinsically hydrophobic Ni(OH)_(2)thick nanosheets(HNHTNs,16 nm)can be transitioned into superhydrophilic Ni(OH)_(2)ultrathin nanosheets(SNHUNs,6.8 nm),where the water contact angle was 0°and the surface free energy increased from 8.6to 65.8 mN·m^(-1),implying *** with HNHTNs,the specific capacitance of SNHUNs is doubled:from 1230 F·g^(-1)(HNHTNs)to 2350 F·g^(-1)(2A·g^(-1))and,even at 20 A·g^(-1),from 833 F·g^(-1)(HNHTNs)to 1670 F·g^(-1).The asymmetric capacitors assembled by SNHUNs and activated carbon show 52.44 Wh·kg^(-1)at 160W·kg^(-1)and excellent stability with~90%retention after5000 cycles(~80%retention after 9500 cycles).The promotion of electrochemical performances is ascribed to the change of surface wettability caused by surface free energy,which greatly increase affinity of electrode to the surrounding liquid environment to reduce the interface resistance and optimize the electron transport path.

关键词： Asymmetric supercapacitor Superhydrophilic interface Transition metal hydroxides Ultrathin nanosheets High specific capacitance

Dynamic recrystallization behavior and strengthening mechanism of a novel Mo-Ti_(3)AlC_(2) alloy at ultrahigh temperature

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Rare Metals 2024年第8期43卷 3946-3960页

作者： Lu Yang Xin-Yuan Zheng Yang zhao Xi-ran Wang Fang-Nao xiao Shi-Zhong Wei School of Materials Science and Engineering Henan University of Science and TechnologyLuoyang 471023China National Joint Engineering Research Center for Abrasion Control and Molding of Metal Materials Henan University of Science and TechnologyLuoyang 471003China Department of Applied Mechanics Univ.Bourgogne FrancheComteFEMTO-ST InstituteCNRS/UF/ENSMM/UTBM25000BesangonFrance

Increasing the recrystallization temperature to achieve better high-temperature performance is critical in the development of molybdenum alloys for ultrahightemperature applications,such as the newest generation of multitype high-temperature nuclear *** this study,an innovative strategy was proposed to improve the performance of molybdenum alloys at high temperature by using the two-dimensional MAX(where M is an early transition metal,A is an A-group element and X is C or N)ceramic material Ti_(3)AlC_(2).The relationships between flow stress,strain rate and temperature were *** microstructure,distribution of misorientation and evolution of dislocations in the Mo-Ti_(3)AlC_(2) alloy were *** microscopic mechanism of the Ti_(3)AlC_(2) phase in the molybdenum alloy at high temperatures was *** experimental results showed that the peak flow stress of Mo-Ti_(3)AlC_(2) at 1600℃ reached 155 MPa,which was161.8% greater than that of pure *** activation energy of thermal deformation of Mo-Ti_(3)AlC_(2) was as large as537 kJ·mol~(-1),which was 17.6% more than that of pure *** recrystallization temperature reached 1600℃ or even *** topological reaction of the Ti_(3)AlC_(2) phase consumed a large amount of energy at high temperatures,resulting in increases in the deformation activation *** structures of AlTi_3 and Ti-O Magneli-phase oxides(Ti_nO_(2n-1)) were formed in-situ,which relied on kink bands and interlayer slip,resulting in many dislocations during ***,the special two-dimensional of the structure Ti_(3)AlC_(2) ceramic inhibited the recrystallization behavior of the Mo *** results of this study can provide theoretical guidance for the development of a new generation of molybdenum alloys for use in ultrahigh-temperature environments.

关键词： Mo alloy Two-dimensional reinforcement Dynamic recrystallization behavior Hot deformation Mechanical properties

Fe3O4@SiO2-Protein A-oHSV/CD63 Ab for Capturing Virus and Exosomes

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Journal of Analysis and Testing 2024年第3期8卷 335-350页

作者： Wenqing Zheng Pingyi Zheng ran zhao Xinyu Xu xiao Zhang xiaoqian Yuan Ying Xu Zichuan Liu Youxin Li Tianjin Key Laboratory for Modern Drug Delivery and High-Eiffciency Collaborative Innovation Center of Chemical Science and Engineering School of Pharmaceutical Science and Technology Faculty of MedicineTianjin University

Protein A modi?ed magnetic spheres (Fe3O4@SiO2-Protein A) with 22.7 emu/g saturation magnetization were prepared and *** spheres had a diameter of 10 nm and was stable up to 229.2°C,and can bond 19.694 mg/g of Protein *** Fe3O4@SiO2-Protein A was?rstly combined with oHSV-BJ-2-A antibody to capture oHSV from disease venom,and the amount of binding virus was 1.92×107to 3.44×107PFU/***3O4@SiO2-Protein A was modi?ed with CD63 antibody,which was further?xed using dissuccinimide octylate （DSS） as a crosslinking *** prepared Fe3O4@Si O2-Protein A-CD63 Ab was useful in isolating and enriching exosomes from cell *** with commercial kits,Fe3O4@SiO2-Protein A-CD63 Ab demonstrated a better puri?cation e?ect,which was successfully monitored using capillary *** total content of exosomes protein extracted using Fe3O4@SiO2-Protein A-CD63 was 3.4 mg/g,which was obviously higher than that reported in some *** addition,Fe3O4@SiO2-Protein A-CD63 Ab also showed its repeatability through bonding and elution of 5 cycles,which was e?ective in cost *** indicated Fe3O4@SiO2-Protein A-CD63 Ab had the potential for large-scale puri?cation of exosomes in practical applications.

关键词： Antibody Exosome Herpes simplex virus Immunomagnetic spheres

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基于修正剑桥模型的三轴试验仿真模拟

岩土力学 2007年第9期28卷 1949-1953页

作者：张昭郭呈周肖昭然同济大学地下建筑与工程系上海200092 河南工业大学土木建筑学院郑州450052

基于虚拟现实思想,研制了三轴试验的计算机虚拟仿真课件。介绍了使用Authorware平台开发研制的三轴试验的计算机仿真课件以及太沙基三轴固结过程中孔隙水压力计算公式,详细论述了基于修正剑桥模型的三轴试验土样在不排水剪切过程中超孔... 详细信息

基于虚拟现实思想,研制了三轴试验的计算机虚拟仿真课件。介绍了使用Authorware平台开发研制的三轴试验的计算机仿真课件以及太沙基三轴固结过程中孔隙水压力计算公式,详细论述了基于修正剑桥模型的三轴试验土样在不排水剪切过程中超孔隙水压力、应力-应变关系、有效应力和总应力的推导过程,并在课件中编程实现。通过利用课件对三轴试验进行模拟操作,不仅能使学生进行系统的试验前的操作训练,而且能够使学生更深刻地掌握土力学的基本原理。

关键词：修正剑桥模型三轴试验超孔隙水压力有效应力路径总应力路径

Multi-Time Scale Operation and Simulation Strategy of the Park Based on Model Predictive Control

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Energy Engineering 2024年第3期121卷 747-767页

作者： Jun zhao Chaoying Yang ran Li Jinge Song Grid Center State Grid Shanxi Electric Power Company Electric Power Science Research InstituteTaiyuan030000China

Due to the impact of source-load prediction power errors and uncertainties,the actual operation of the park will have a wide range of fluctuations compared with the expected state,resulting in its inability to achieve the expected *** paper constructs an operating simulation model of the park power grid operation considering demand response and proposes a multi-time scale operating simulation method that combines day-ahead optimization and model predictive control(MPC).In the day-ahead stage,an operating simulation plan that comprehensively considers the user’s side comfort and operating costs is proposed with a long-term time scale of 15 *** order to cope with power fluctuations of photovoltaic,wind turbine and conventional load,MPC is used to track and roll correct the day-ahead operating simulation plan in the intra-day stage to meet the actual operating operation status of the ***,the validity and economy of the operating simulation strategy are verified through the analysis of arithmetic examples.

关键词： Demand response model predictive control multiple time scales operating simulation

Current understanding of ELF4 deficiency:a novel inborn error of immunity

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World Journal of Pediatrics 2024年第5期20卷 444-450页

作者： Hong-Qiang Du xiao-Dong zhao Department of Rheumatology&Immunology National Clinical Research Center for Child Health and DisordersMinistry of Education Key Laboratory of Child Development and DisordersChongqing Key Laboratory of Child Rare Diseases in Infection and ImmunityChildren’s Hospital of Chongqing Medical UniversityZhongshan Er Road 136Yuzhong DistrictChongqingChina

Background ELF4 deficiency has been recently recognized as a novel disorder within the spectrum of inborn errors of immunity(IEIs),specifically categorized as a“disease of immune dysregulation.”Cases of this condition,reported by our team and others,are very limited *** such,our current knowledge of this new disease remains *** review aims to provide a brief overview of the clinical manifestations,pathogenesis,and treatment strategies for this novel *** sources A comprehensive review was conducted after an extensive literature search in the PubMed/Medline database and websites concerning transcriptional factor ELF4 and reports concerning patients with ELF4 *** search strategy was“ELF4 OR ETS-related transcription factor Elf-4 OR EL4-like factor 4 OR myeloid Elf-1-like factor”as of the time of manuscript *** The current signature manifestations of ELF4 deficiency disorder are recurrent and prolonged oral ulcer,abdominal pain,and diarrhea in pediatric *** some cases,immunodeficiency and autoimmunity can also be *** Sanger sequencing or whole exome sequencing can be used to detect variation in ELF4 *** blotting for ELF4 expression of the patient’s cells can confirm the pathogenic effect of the *** fully confirm the pathogenicity of the variant,further functional test is strongly *** and biologics are the mainstream management of ELF4 deficiency *** Pediatric males presenting with recurring ulcerations in digestive tract epithelium with or without recurrent fever should be suspected of *** atypical presentations are prominent,variations in ELF4 gene should be carefully evaluated functionally due to the complex nature of ELF4 *** of treating DEX includes use of glucocorticoid and biologics and more precise treatment needs more patients to identify and further mechanistic study.

关键词： ELF4 transcription factor Immune dysregulation Inborn errors of immunity Mechanism Recurrent infections

Tuning mechanical and electrical performances of B_(4)C-TiB_(2)ceramics in a two-step spark plasma sintering process

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Journal of Advanced Ceramics 2024年第4期13卷 518-528页

作者： Jun zhao Xingshuo Zhang Zongning Ma Dong Wang Xing Jin Songlin ran Advanced Ceramics Research Center School of Materials Science and EngineeringAnhui University of TechnologyMaanshan 243002China Anhui Engineering Research Center for High Efficiency Intelligent Photovoltaic Module Chaohu UniversityHefei 238024China

B_(4)C–TiB_(2)is an advanced electrically conductive ceramic with excellent mechanical and electrical discharge machinable *** is challenging and rewarding to achieve highly conductive and hard B_(4)C–TiB_(2)composites at a minimum content of conductive TiB2 that has inferior hardness but double specific gravity of the B_(4)C matrix.A novel strategy was used to construct conductive networks in B_(4)C‒15 vol%TiB2 composite ceramics with B_(4)C,TiC,and amorphous B as raw materials by a two-step spark plasma sintering *** influences of particle size matching between B_(4)C and TiC on the conducting of the strategy and the microstructure were discussed based on the selective matrix grain growth *** mechanical and electrical properties were also systematically *** B_(4)C–15 vol%TiB2 composite ceramic prepared from 10.29µm B_(4)C and 0.05µm TiC powders exhibited a perfect three-dimensional interconnected conductive network with a maximum electrical conductivity of 4.25×10^(4)S/m,together with excellent mechanical properties including flexural strength,Vickers hardness,and fracture toughness of 691±58 MPa,30.30±0.61 GPa,and 5.75±0.32 MPa·m^(1/2),respectively,while the composite obtained from 3.12µm B_(4)C and 0.8µm TiC powders had the best mechanical properties including flexural strength,Vickers hardness,and fracture toughness of 827±35 MPa,32.01±0.51 GPa,and 6.45±0.22 MPa·m^(1/2),together with a decent electrical conductivity of 0.65×10^(4)S/m.

关键词： B_(4)C-TiB_(2) mechanical properties electrical conductivity conductive network

Microbiome in Female Reproductive Health:Implications for Fertility and Assisted Reproductive Technologies

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Genomics, Proteomics & Bioinformatics 2024年第1期22卷 5-18页

作者： Liwen xiao Zhenqiang Zuo Fangqing zhao CAS Key Laboratory of Systems Biology Hangzhou Institute for Advanced StudyUniversity of Chinese Academy of SciencesHangzhou 310024China Beijing Institutes of Life Science/Institute of Zoology Chinese Academy of SciencesBeijing 100101China University of Chinese Academy of Sciences Beijing 100049China

The microbiome plays a critical role in the process of conception and the outcomes of *** in microbiome homeostasis in women of reproductive age can lead to various pregnancy complications,which significantly impact maternal and fetal *** studies have associated the microbiome in the female reproductive tract(FRT)with assisted reproductive technology(ART)outcomes,and restoring microbiome balance has been shown to improve fertility in infertile *** review provides an overview of the role of the microbiome in female reproductive health,including its implications for pregnancy outcomes and ***,recent advances in the use of microbial biomarkers as indicators of pregnancy disorders are summarized.A comprehensive understanding of the characteristics of the microbiome before and during pregnancy and its impact on reproductive health will greatly promote maternal and fetal *** knowledge can also contribute to the development of ARTs and microbiome-based interventions.

关键词： Microbiome Pregnancy Female reproductive health Assisted reproductive technology Microbial biomarker