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界面电子扰动促进的C–H键活化
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作者 王哲 王春鹏 +3 位作者 陆冰 陈志荣 王勇 毛善俊 《Chinese Journal of Catalysis》 SCIE CAS CSCD 2024年第1期130-138,共9页
丙烯是重要的化工原料,广泛用于生产聚丙烯、环氧丙烷、丙烯醛、丙烯腈和丙酮等重要化工中间体以及合成树脂、合成橡胶和许多精细化工产品.目前生产丙烯的方法主要有石脑油裂解、催化流化裂化、丙烷脱氢、烯烃复分解和甲醇制烯烃等.其... 丙烯是重要的化工原料,广泛用于生产聚丙烯、环氧丙烷、丙烯醛、丙烯腈和丙酮等重要化工中间体以及合成树脂、合成橡胶和许多精细化工产品.目前生产丙烯的方法主要有石脑油裂解、催化流化裂化、丙烷脱氢、烯烃复分解和甲醇制烯烃等.其中丙烷脱氢因具有较高的丙烯选择性和较低的原料成本而备受关注,尤其是页岩气在全球的大量发现和开采,使得丙烷的原料成本持续下降,丙烷脱氢技术的迅速发展,但高效催化剂研发成为提升生产效率的关键.商业Pt基催化剂通常采用合金化的手段优化Pt颗粒的表面结构和中间体的吸附状态,进而获得较好的催化性能,但金属助剂的引入在一定程度上会弱化Pt位点的C–H键活化能力.针对该问题,本文从惰性C–H键活化角度出发,揭示了一种新的C–H键界面活化机制.通过金属-载体强相互作用诱导形成Pt-Ga_(2)O_(3)反向界面结构,密度泛函理论计算结果表明,Pt与Ga_(2)O_(3)之间存在强烈的电子扰动现象,使得界面处O位点表现出类金属的电子特性,在费米能级附近存在连续的电子态,这与Ga_(2)O_(3)本身离散性电子态呈明显对比,显示出Pt-Ga_(2)O_(3)反向界面结构的独特性质,使得界面O位点表现出极强的H吸附能和C–H键活化能力,其催化丙烷分子中亚甲基C–H键断裂的活化能仅为0.21 eV,远低于Pt(111)晶面的0.64 eV.原位红外光谱结果表明,反应过程中该界面结构会产生大量的羟基.根据过渡态的精细结构可知,反应位点是通过抓取H原子并随即稳定产生的C自由基完成C–H键的断裂,分析结果表明,H吸附能与反应能垒有着紧密的关联,而Pt-Ga_(2)O_(3)反向界面结构中,Pt基底赋予界面O位点独特的电子结构,同时也可以作为电子受体接收H传递的电子,从而表现出极强的H结合能和C–H键活化能力,其C–H断裂能垒要远低于各类Pt位点.进一步的分析表明,首个C–H键在Pt–O界面位发生断裂后,所形成的H物种会由O位点溢流至Pt颗粒表面,最终以H_(2)形式释放,留下的2-丙基碎片再经历甲基的C–H键断裂、H溢流、脱氢等步骤形成丙烯分子.而Pt颗粒表面的Ga_(2)O_(3)团簇也起到分割表面位点的作用,促进丙烯脱附的同时,有效弱化C–C键的断裂趋势,减少裂解副产物,生成丙烯的选择性超过99%.综上所述,本文构建的Pt/Ga-Al_(2)O_(3)界面位催化剂在丙烷脱氢反应中的性能要明显优于Pt/Al_(2)O_(3)以及工业常用的PtSn/Al_(2)O_(3)催化剂,揭示了一种全新的C–H键活化策略,并探究其中的化学机制,既可以深化对界面协同催化的理解,又可以为高性能催化剂的设计提供借鉴和指导. 展开更多
关键词 界面催化 碳氢键活化 丙烷脱氢 电子效应
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“溶剂剪刀”克服惰性氢键促进常压氧气下高效催化氧化芳香烃
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作者 金魁 张美云 +6 位作者 车鹏华 孙冬茹 王永 马红 张巧红 陈晨 徐杰 《Chinese Journal of Catalysis》 SCIE CAS CSCD 2024年第6期322-330,共9页
氢键是调节各类催化反应体系中分子行为的重要作用力,能够有效活化分子、改变作用位置及控制反应途径,具有重要的科学意义和应用潜力.然而,氢键的利用过程存在着惰性效应难题,严重阻碍反应的顺利进行.如何有针对性地打破惰性的氢键作用... 氢键是调节各类催化反应体系中分子行为的重要作用力,能够有效活化分子、改变作用位置及控制反应途径,具有重要的科学意义和应用潜力.然而,氢键的利用过程存在着惰性效应难题,严重阻碍反应的顺利进行.如何有针对性地打破惰性的氢键作用力,探索氢键的构建与破坏机制,成为提高反应转化效率和选择性的重要途径,有利于实现高原子经济性并减少碳足迹.芳香烃氧化制羧酸是工业上重要的催化氧化过程,但存在高能耗、副产物多以及二氧化碳排放等问题.本文以甲苯液相氧气氧化制苯甲酸为模型反应,提出了旨在克服惰性氢键的"溶剂剪刀"策略.通过利用氢键受体溶剂(如醋酸、醋酸乙酯、氯乙酸乙酯或氯乙酸甲酯)作为破坏试剂,与强氢键供体溶剂六氟异丙醇(HFIP)形成氢键,从而将关键中间体苯甲醛从惰性的氢键结合状态中释放出来,将甲苯在温和条件下高效氧化为苯甲酸.使用NHPI/金属醋酸盐/HFIP-HOAc作为催化体系,在温和的反应条件(45°C,0.1 MPa O_(2))下反应4 h,甲苯转化率达到96.8%,苯甲酸选择性达98.7%.该方法不仅成功实现了甲苯到苯甲酸的高效转化,还可进一步拓展至邻(间,对)甲基甲苯等甲基芳烃,在25‒45°C和常压氧气条件下高效氧化制备芳香羧酸.利用变浓度核磁共振实验,定量测定了氢键供体HFIP与不同“剪刀溶剂”形成氢键的标准吉布斯自由能变化(ΔG^(0)).结果显示,‒ΔG^(0)顺序为醋酸>醋酸乙酯>氯乙酸乙酯>氯乙酸甲酯,其中醋酸的ΔG^(0)达到‒4.319 kJ/mol,具有最强的氢键裁剪能力.实验显示,‒ΔG^(0)与周转次数(TON)值(促进苯甲醛氧化的能力)的顺序一致,表明氢键裁剪能力越强的“溶剂-剪刀”越有利于促进苯甲醛的氧化.综上,本文利用“溶剂-剪刀”重建了甲基芳烃氧化反应中的氢键平衡体系,切断了使苯甲醛惰性化的氢键,促进游离苯甲醛的释放,使甲基芳香烃能在温和条件下高效氧化为芳香酸.本研究为有机合成普遍存在的氢键惰性化效应提供了解决思路,有利于促进“氢键调控”在有机合成的应用. 展开更多
关键词 氢键 芳香烃 选择氧化 溶剂剪刀 六氟异丙醇
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Innovative Solutions for High-Performance Silicon Anodes in Lithium-Ion Batteries:Overcoming Challenges and Real-World Applications 被引量:1
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作者 Mustafa Khan Suxia Yan +6 位作者 Mujahid Ali Faisal Mahmood Yang Zheng Guochun Li Junfeng Liu Xiaohui Song yong wang 《Nano-Micro Letters》 SCIE EI CAS CSCD 2024年第9期341-384,共44页
Silicon(Si)has emerged as a potent anode material for lithium-ion batteries(LIBs),but faces challenges like low electrical conductivity and significant volume changes during lithiation/delithiation,leading to material... Silicon(Si)has emerged as a potent anode material for lithium-ion batteries(LIBs),but faces challenges like low electrical conductivity and significant volume changes during lithiation/delithiation,leading to material pulverization and capacity degradation.Recent research on nanostructured Si aims to mitigate volume expansion and enhance electrochemical performance,yet still grapples with issues like pulverization,unstable solid electrolyte interface(SEI)growth,and interparticle resistance.This review delves into innovative strategies for optimizing Si anodes’electrochemical performance via structural engineering,focusing on the synthesis of Si/C composites,engineering multidimensional nanostructures,and applying non-carbonaceous coatings.Forming a stable SEI is vital to prevent electrolyte decomposition and enhance Li^(+)transport,thereby stabilizing the Si anode interface and boosting cycling Coulombic efficiency.We also examine groundbreaking advancements such as self-healing polymers and advanced prelithiation methods to improve initial Coulombic efficiency and combat capacity loss.Our review uniquely provides a detailed examination of these strategies in real-world applications,moving beyond theoretical discussions.It offers a critical analysis of these approaches in terms of performance enhancement,scalability,and commercial feasibility.In conclusion,this review presents a comprehensive view and a forward-looking perspective on designing robust,high-performance Si-based anodes the next generation of LIBs. 展开更多
关键词 Silicon anode Energy storage NANOSTRUCTURE Prelithiation BINDER
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Elastic-viscoplastic behaviors of polymer-blend geocell sheets:Numerical and experimental investigations 被引量:1
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作者 Yang Zhao Jianbin Chen +7 位作者 Zheng Lu Jie Liu Abdollah Tabaroei Chuxuan Tang yong wang Lipeng Wu Bo wang Hailin Yao 《Journal of Rock Mechanics and Geotechnical Engineering》 SCIE CSCD 2024年第10期4261-4271,共11页
Polymer-blend geocell sheets(PBGS)have been developed as substitute materials for manufacturing geocells.Various attempts have been made to test and predict the behaviors of commonly used geogrids,geotextiles,geomembr... Polymer-blend geocell sheets(PBGS)have been developed as substitute materials for manufacturing geocells.Various attempts have been made to test and predict the behaviors of commonly used geogrids,geotextiles,geomembranes,and geocells.However,the elastic-viscoplastic behaviors of novel-developed geocell sheets are still poorly understood.Therefore,this paper investigates the elastic-viscoplastic behaviors of PBGS to gain a comprehensive understanding of their mechanical properties.Furthermore,the tensile load-strain history under various loading conditions is simulated by numerical calculation for widespread utilization.To achieve this goal,monotonic loading tests,short-term creep and stress relaxation tests,and multi-load-path tests(also known as arbitrary loading history tests)are performed using a universal testing machine.The results are simulated using the nonlinear three-component(NLTC)model,which consists of three nonlinear components,i.e.a hypo-elastic component,a nonlinear inviscid component,and a nonlinear viscid component.The experimental and numerical results demonstrate that PBGS exhibit significant elastic-viscoplastic behavior that can be accurately predicted by the NLTC model.Moreover,the tensile strain rates significantly influence the tensile load,with higher strain rates resulting in increased tensile loads and more linear load-strain curves.Also,parametric analysis of the rheological characteristics reveals that the initial tensile strain rates have negligible impact on the results.The rate-sensitivity coefficient of PBGS is approximately 0.163,which falls within the typical range observed in most geosynthetics. 展开更多
关键词 Polymer-blend geocell sheets Geosynthetics Elastic-viscoplastic behavior Numerical simulations Tensile load-strain response
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Cyanidin-3-glucoside protects the photooxidative damage of retinal pigment epithelium cells by regulating sphingolipid signaling and inhibiting MAPK pathway 被引量:1
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作者 Tingting Liu Wentao Qi +2 位作者 Wenting Peng Jianan Zhang yong wang 《Food Science and Human Wellness》 SCIE CSCD 2024年第2期621-632,共12页
Cyanidin-3-glucoside(C3G)is the most common anthocyanin in dark grains and berries and is a food functional factor to improve visual health.However,the mechanisms of C3G on blue light-induced retinal pigment epithelia... Cyanidin-3-glucoside(C3G)is the most common anthocyanin in dark grains and berries and is a food functional factor to improve visual health.However,the mechanisms of C3G on blue light-induced retinal pigment epithelial(RPE)cell photooxidative damage needs further exploration.We investigated the effects of C3G on blue light-irradiated A2E-containing RPE cells and explored whether sphingolipid,mitogen-activated protein kinase(MAPK),and mitochondria-mediated pathways are involved in this mechanism.Blue light irradiation led to mitochondria and lysosome damage in RPE cells,whereas C3G preserved mitochondrial morphology and function and maintained the lysosomal integrity.C3G suppressed the phosphorylation of JNK and p38 MAPK and mitochondria-mediated pathways to inhibit RPE cell apoptosis.Lipidomics data showed that C3G protected RPE cells against blue light-induced lipid peroxidation and apoptosis by maintaining sphingolipids balance.C3G significantly inhibited ceramide(Cer d18:0/15:0,Cer d18:0/16:0 and Cer d18:0/18:0)accumulation and elevated galactosylceramide(GalCer d18:1/15:0 and GalCer d18:1/16:0)levels in the irradiated A2E-containing RPE cells.Furthermore,C3G attenuated cell membrane damage by increasing phosphatidylcholine and phosphatidylserine levels.C3G inhibited apoptosis and preserved the structure of mitochondria and lysosome by regulating sphingolipid signaling and suppression of MAPK activation in RPE cells.Thus,dietary supplementation of C3G prevents retinal photooxidative damage. 展开更多
关键词 Cyanidin-3-glucoside CERAMIDE MAPK pathway Mitochondria-dependent apoptosis Lipidomics analysis
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"Five steps four quadrants" modularized en bloc dissection technique for accessing hepatic hilum lymph nodes in laparoscopic pancreaticoduodenectomy 被引量:1
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作者 Xiao-Si Hu yong wang +5 位作者 Hong-Tao Pan Chao Zhu Shi-Lei Chen Hui-Chun Liu Qing Pang Hao Jin 《World Journal of Gastrointestinal Surgery》 SCIE 2024年第2期503-510,共8页
BACKGROUND Although en bloc dissection of hepatic hilum lymph nodes has many advantages in radical tumor treatment,the feasibility and safety of this approach for laparo-scopic pancreaticoduodenectomy(LPD)require furt... BACKGROUND Although en bloc dissection of hepatic hilum lymph nodes has many advantages in radical tumor treatment,the feasibility and safety of this approach for laparo-scopic pancreaticoduodenectomy(LPD)require further clinical evaluation and investigation.AIM To explore the application value of the"five steps four quadrants"modularized en bloc dissection technique for accessing hepatic hilum lymph nodes in LPD patients.METHODS A total of 52 patients who underwent LPD via the"five steps four quadrants"modularized en bloc dissection technique for hepatic hilum lymph nodes from April 2021 to July 2023 in our department were analyzed retrospectively.The patients'body mass index(BMI),preoperative laboratory indices,intraoperative variables and postoperative complications were recorded.The relationships between preoperative data and intraoperative lymph node dissection time and blood loss were also analyzed.RESULTS Among the 52 patients,36 were males and 16 were females,and the average age was 62.2±11.0 years.There were 26 patients with pancreatic head cancer,16 patients with periampullary cancer,and 10 patients with distal bile duct cancer.The BMI was 22.3±3.3 kg/m²,and the median total bilirubin(TBIL)concentration was 57.7(16.0-155.7)µmol/L.All patients successfully underwent the"five steps four quadrants"modularized en bloc dissection technique without lymph node clearance-related complications such as postoperative bleeding or lymphatic leakage.Correlation analysis revealed significant associations between preoperative BMI(r=0.3581,P=0.0091),TBIL level(r=0.2988,P=0.0341),prothrombin time(r=0.3018,P=0.0297)and lymph node dissection time.Moreover,dissection time was significantly correlated with intraoperative blood loss(r=0.7744,P<0.0001).Further stratified analysis demonstrated that patients with a preoperative BMI≥21.9 kg/m²and a TIBL concentration≥57.7μmol/L had significantly longer lymph node dissection times(both P<0.05).CONCLUSION The"five steps four quadrants"modularized en bloc dissection technique for accessing the hepatic hilum lymph node is safe and feasible for LPD.This technique is expected to improve the efficiency of hepatic hilum lymph node dissection and shorten the learning curve;thus,it is worthy of further clinical promotion and application. 展开更多
关键词 Five steps four quadrants Hepatic hilum lymph node Modularized en bloc clearance Laparoscopic pancreaticoduodenectomy
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Long-term operation optimization of circulating cooling water systems under fouling conditions
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作者 Jiarui Liang yong Tian +3 位作者 Shutong Yang yong wang Ruiqi Yin Yufei wang 《Chinese Journal of Chemical Engineering》 SCIE EI CAS CSCD 2024年第1期255-267,共13页
Fouling caused by excess metal ions in hard water can negatively impact the performance of the circulating cooling water system(CCWS)by depositing ions on the heat exchanger's surface.Currently,the operation optim... Fouling caused by excess metal ions in hard water can negatively impact the performance of the circulating cooling water system(CCWS)by depositing ions on the heat exchanger's surface.Currently,the operation optimization of CCWS often prioritizes short-term flow velocity optimization for minimizing power consumption,without considering fouling.However,low flow velocity promotes fouling.Therefore,it's crucial to balance fouling and energy/water conservation for optimal CCWS long-term operation.This study proposes a mixed-integer nonlinear programming(MINLP)model to achieve this goal.The model considers fouling in the pipeline,dynamic concentration cycle,and variable frequency drive to optimize the synergy between heat transfer,pressure drop,and fouling.By optimizing the concentration cycle of the CCWS,water conservation and fouling control can be achieved.The model can obtain the optimal operating parameters for different operation intervals,including the number of pumps,frequency,and valve local resistance coefficient.Sensitivity experiments on cycle and environmental temperature reveal that as the cycle increases,the marginal benefits of energy/water conservation decrease.In periods with minimal impact on fouling rate,energy/water conservation can be achieved by increasing the cycle while maintaining a low fouling rate.Overall,the proposed model has significant energy/water saving effects and can comprehensively optimize the CCWS through its incorporation of fouling and cycle optimization. 展开更多
关键词 Computer simulation Circulating water system FOULING Concentration cycle OPTIMIZATION Variable frequency drive
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Scientific Advances and Weather Services of the China Meteorological Administration’s National Forecasting Systems during the Beijing 2022 Winter Olympics
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作者 Guo DENG Xueshun SHEN +23 位作者 Jun DU Jiandong GONG Hua TONG Liantang DENG Zhifang XU Jing CHEN Jian SUN yong wang Jiangkai HU Jianjie wang Mingxuan CHEN Huiling YUAN Yutao ZHANG Hongqi LI Yuanzhe wang Li GAO Li SHENG Da LI Li LI Hao wang Ying ZHAO Yinglin LI Zhili LIU Wenhua GUO 《Advances in Atmospheric Sciences》 SCIE CAS CSCD 2024年第5期767-776,共10页
Since the Beijing 2022 Winter Olympics was the first Winter Olympics in history held in continental winter monsoon climate conditions across complex terrain areas,there is a deficiency of relevant research,operational... Since the Beijing 2022 Winter Olympics was the first Winter Olympics in history held in continental winter monsoon climate conditions across complex terrain areas,there is a deficiency of relevant research,operational techniques,and experience.This made providing meteorological services for this event particularly challenging.The China Meteorological Administration(CMA)Earth System Modeling and Prediction Centre,achieved breakthroughs in research on short-and medium-term deterministic and ensemble numerical predictions.Several key technologies crucial for precise winter weather services during the Winter Olympics were developed.A comprehensive framework,known as the Operational System for High-Precision Weather Forecasting for the Winter Olympics,was established.Some of these advancements represent the highest level of capabilities currently available in China.The meteorological service provided to the Beijing 2022 Games also exceeded previous Winter Olympic Games in both variety and quality.This included achievements such as the“100-meter level,minute level”downscaled spatiotemporal resolution and forecasts spanning 1 to 15 days.Around 30 new technologies and over 60 kinds of products that align with the requirements of the Winter Olympics Organizing Committee were developed,and many of these techniques have since been integrated into the CMA’s operational national forecasting systems.These accomplishments were facilitated by a dedicated weather forecasting and research initiative,in conjunction with the preexisting real-time operational forecasting systems of the CMA.This program represents one of the five subprograms of the WMO’s high-impact weather forecasting demonstration project(SMART2022),and continues to play an important role in their Regional Association(RA)II Research Development Project(Hangzhou RDP).Therefore,the research accomplishments and meteorological service experiences from this program will be carried forward into forthcoming highimpact weather forecasting activities.This article provides an overview and assessment of this program and the operational national forecasting systems. 展开更多
关键词 Beijing Winter Olympic Games CMA national forecasting system data assimilation ensemble forecast bias correction and downscaling machine learning-based fusion methods
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Dynamic performance and parameter optimization of a half-vehicle system coupled with an inerter-based X-structure nonlinear energy sink
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作者 yong wang Peili wang +1 位作者 Haodong MENG Liqun CHEN 《Applied Mathematics and Mechanics(English Edition)》 SCIE EI CSCD 2024年第1期85-110,共26页
Inspired by the demand of improving the riding comfort and meeting the lightweight design of the vehicle, an inerter-based X-structure nonlinear energy sink(IXNES) is proposed and applied in the half-vehicle system to... Inspired by the demand of improving the riding comfort and meeting the lightweight design of the vehicle, an inerter-based X-structure nonlinear energy sink(IXNES) is proposed and applied in the half-vehicle system to enhance the dynamic performance. The X-structure is used as a mechanism to realize the nonlinear stiffness characteristic of the NES, which can realize the flexibility, adjustability, high efficiency, and easy operation of nonlinear stiffness, and is convenient to apply in the vehicle suspension, and the inerter is applied to replacing the mass of the NES based on the mass amplification characteristic. The dynamic model of the half-vehicle system coupled with the IX-NES is established with the Lagrange theory, and the harmonic balance method(HBM) and the pseudo-arc-length method(PALM) are used to obtain the dynamic response under road harmonic excitation. The corresponding dynamic performance under road harmonic and random excitation is evaluated by six performance indices, and compared with that of the original half-vehicle system to show the benefits of the IX-NES. Furthermore, the structural parameters of the IX-NES are optimized with the genetic algorithm. The results show that for road harmonic and random excitation, using the IX-NES can greatly reduce the resonance peaks and root mean square(RMS) values of the front and rear suspension deflections and the front and rear dynamic tire loads, while the resonance peaks and RMS values of the vehicle body vertical and pitching accelerations are slightly larger.When the structural parameters of the IX-NES are optimized, the vehicle body vertical and pitching accelerations of the half-vehicle system could reduce by 2.41% and 1.16%,respectively, and the other dynamic performance indices are within the reasonable ranges.Thus, the IX-NES combines the advantages of the inerter, X-structure, and NES, which improves the dynamic performance of the half-vehicle system and provides an effective option for vibration attenuation in the vehicle engineering. 展开更多
关键词 inerter X-structure nonlinear energy sink(NES) half-vehicle system dynamic performance
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Engineering hydrophobic protective layers on zinc anodes for enhanced performance in aqueous zinc-ion batteries
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作者 Taofeng Li Suxia Yan +12 位作者 Hongyu Dong Yang Zheng Kun Ming Ying Chen Haitao Li Guochun Li Zhixia He Weimin Li Quan wang Xiaohui Song Junfeng Liu Edison Huixiang Ang yong wang 《Journal of Energy Chemistry》 SCIE EI CAS CSCD 2024年第10期1-11,I0001,共12页
Aqueous zinc-ion batteries possess substantial potential for energy storage applications;however,they are hampered by challenges such as dendrite formation and uncontrolled side reactions occurring at the zinc anode.I... Aqueous zinc-ion batteries possess substantial potential for energy storage applications;however,they are hampered by challenges such as dendrite formation and uncontrolled side reactions occurring at the zinc anode.In our investigation,we sought to mitigate these issues through the utilization of in situ zinc complex formation reactions to engineer hydrophobic protective layers on the zinc anode surface.These robust interfacial layers serve as effective barriers,isolating the zinc anode from the electrolyte and active water molecules and thereby preventing hydrogen evolution and the generation of undesirable byproducts.Additionally,the presence of numerous zincophilic sites within these protective layers facilitates uniform zinc deposition while concurrently inhibiting dendrite growth.Through comprehensive evaluation of functional anodes featuring diverse functional groups and alkyl chain lengths,we meticulously scrutinized the underlying mechanisms influencing performance variations.This analysis involved precise modulation of interfacial hydrophobicity,rapid Zn^(2+)ion transport,and ordered deposition of Zn^(2+)ions.Notably,the optimized anode,fabricated with octadecylphosphate(OPA),demonstrated exceptional performance characteristics.The Zn//Zn symmetric cell exhibited remarkable longevity,exceeding 4000 h under a current density of 2 mA cm^(-2)and a capacity density of 2 mA h cm^(-2),Furthermore,when integrated with a VOH cathode,the complete cell exhibited superior capacity retention compared to anodes modified with alternative organic molecules. 展开更多
关键词 Aqueous zinc-ion batteries Hydrophobic protective layers Zinc anode stability Dendrite growth inhibition Energy storage
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Effect of hafnium and molybdenum addition on inclusion characteristics in Co-based dual-phase high-entropy alloys
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作者 yong wang Wei wang +1 位作者 Joo Hyun Park wangzhong Mu 《International Journal of Minerals,Metallurgy and Materials》 SCIE EI CAS CSCD 2024年第7期1639-1650,共12页
Specific grades of high-entropy alloys(HEAs)can provide opportunities for optimizing properties toward high-temperature applications.In this work,the Co-based HEA with a chemical composition of Co_(47.5)Cr_(30)Fe_(7.5... Specific grades of high-entropy alloys(HEAs)can provide opportunities for optimizing properties toward high-temperature applications.In this work,the Co-based HEA with a chemical composition of Co_(47.5)Cr_(30)Fe_(7.5)Mn_(7.5)Ni_(7.5)(at%)was chosen.The refractory metallic elements hafnium(Hf)and molybdenum(Mo)were added in small amounts(1.5at%)because of their well-known positive effects on high-temperature properties.Inclusion characteristics were comprehensively explored by using a two-dimensional cross-sectional method and extracted by using a three-dimensional electrolytic extraction method.The results revealed that the addition of Hf can reduce Al_(2)O_(3)inclusions and lead to the formation of more stable Hf-rich inclusions as the main phase.Mo addition cannot influence the inclusion type but could influence the inclusion characteristics by affecting the physical parameters of the HEA melt.The calculated coagulation coefficient and collision rate of Al_(2)O_(3)inclusions were higher than those of HfO_(2)inclusions,but the inclusion amount played a larger role in the agglomeration behavior of HfO_(2)and Al_(2)O_(3)inclusions.The impurity level and active elements in HEAs were the crucial factors affecting inclusion formation. 展开更多
关键词 high-entropy alloy non-metallic inclusion AGGLOMERATION thermodynamics ALLOYING
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Dredged marine soil stabilization using magnesia cement augmented with biochar/slag
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作者 Chikezie Chimere Onyekwena Qi Li +5 位作者 yong wang Ishrat Hameed Alvi Wentao Li Yunlu Hou Xianwei Zhang Min Zhang 《Journal of Rock Mechanics and Geotechnical Engineering》 SCIE CSCD 2024年第3期1000-1017,共18页
Dredged marine soils(DMS)have poor engineering properties,which limit their usage in construction projects.This research examines the application of reactive magnesia(rMgO)containing supplementary cementitious materia... Dredged marine soils(DMS)have poor engineering properties,which limit their usage in construction projects.This research examines the application of reactive magnesia(rMgO)containing supplementary cementitious materials(SCMs)to stabilize DMS under ambient and carbon dioxide(CO_(2))curing conditions.Several proprietary experimental tests were conducted to investigate the stabilized DMS.Furthermore,the carbonation-induced mineralogical,thermal,and microstructural properties change of the samples were explored.The findings show that the compressive strength of the stabilized DMS fulfilled the 7-d requirement(0.7-2.1 MPa)for pavement and building foundations.Replacing rMgO with SCMs such as biochar or ground granulated blast-furnace slag(GGBS)altered the engineering properties and particle packing of the stabilized soils,thus influencing their performances.Biochar increased the porosity of the samples,facilitating higher CO_(2) uptake and improved ductility,while GGBS decreased porosity and increased the dry density of the samples,resulting in higher strength.The addition of SCMs also enhanced the water retention capacity and modified the pH of the samples.Microstructural analysis revealed that the hydrated magnesium carbonates precipitated in the carbonated samples provided better cementation effects than brucite formed during rMgO hydration.Moreover,incorporating SCMs reduced the overall global warming potential and energy demand of the rMgO-based systems.The biochar mixes demonstrated lower toxicity and energy consumption.Ultimately,the rMgO and biochar blend can serve as an environmentally friendly additive for soft soil stabilization and permanent fixation of significant amounts of CO_(2) in soils through mineral carbonation,potentially reducing environmental pollution while meeting urbanization needs. 展开更多
关键词 Dredged marine soil CO_(2)uptake Reactive magnesia BIOCHAR Ground granulated blast-furnace slag
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TuBG1 promotes hepatocellular carcinoma via ATR/P53-apoptosis and cycling pathways
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作者 Yan Zhang Zhen-Zhen wang +4 位作者 An-Qi Han Ming-Ya Yang Li-Xin Zhu Fa-Ming Pan yong wang 《Hepatobiliary & Pancreatic Diseases International》 SCIE CAS CSCD 2024年第2期195-209,共15页
Background:As reported,γ-tubulin(TuBG1)is related to the occurrence and development of various types of malignant tumors.However,its role in hepatocellular cancer(HCC)is not clear.The present study was to investigate... Background:As reported,γ-tubulin(TuBG1)is related to the occurrence and development of various types of malignant tumors.However,its role in hepatocellular cancer(HCC)is not clear.The present study was to investigate the relationship between TuBG1 and clinical parameters and survival in HCC patients.Methods:The correlation between TuBG1 and clinical parameters and survival in HCC patients was ex-plored by bioinformatics analysis.Immunohistochemistry was used for the verification.The molecular function of TuBG1 was measured using colony formation,scratch assay,trans-well assay and flow cytometry.Gene set enrichment analysis(GSEA)was used to pick up the enriched pathways,followed by investigating the target pathways using Western blotting.The tumor-immune system interactions and drug bank database(TISIDB)was used to evaluate TuBG1 and immunity.Based on the TuBG1-related immune genes,a prognostic model was constructed and was further validated internally and externally.Results:The bioinformatic analysis found high expressed TuBG1 in HCC tissue,which was confirmed us-ing immunohistochemistry and Western blotting.After silencing the TuBG1 in HCC cell lines,more G1 arrested cells were found,cell proliferation and invasion were inhibited,and apoptosis was promoted.Furthermore,the silence of TuBG1 increased the expressions of Ataxia-Telangiectasia and Rad-3(ATR),phospho-P38 mitogen-activated protein kinase(P-P38MAPK),phospho-P53(P-P53),B-cell lymphoma-2 associated X protein(Bax),cleaved caspase 3 and P21;decreased the expressions of B-cell lymphoma-2(Bcl-2),cyclin D1,cyclin E2,cyclin-dependent kinase 2(CDK2)and CDK4.The correlation analysis of immunohistochemistry and clinical parameters and survival data revealed that TuBG1 was negatively corre-lated with the overall survival.The constructed immune prognosis model could effectively evaluate the prognosis.Conclusions:The increased expression of TuBG1 in HCC is associated with poor prognosis,which might be involved in the occurrence and development of HCC. 展开更多
关键词 TuBG1 Hepatocellular carcinoma APOPTOSIS Cell cycling IMMUNOMODULATORS
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A Neural-network-based Alternative Scheme to Include Nonhydrostatic Processes in an Atmospheric Dynamical Core
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作者 Yang XIA Bin wang +13 位作者 Lijuan LI Li LIU Jianghao LI Li DONG Shiming XU Yiyuan LI Wenwen XIA Wenyu HUANG Juanjuan LIU yong wang Hongbo LIU Ye PU Yujun HE Kun XIA 《Advances in Atmospheric Sciences》 SCIE CAS CSCD 2024年第6期1083-1099,I0002,I0003,共19页
Here,a nonhydrostatic alternative scheme(NAS)is proposed for the grey zone where the nonhydrostatic impact on the atmosphere is evident but not large enough to justify the necessity to include an implicit nonhydrostat... Here,a nonhydrostatic alternative scheme(NAS)is proposed for the grey zone where the nonhydrostatic impact on the atmosphere is evident but not large enough to justify the necessity to include an implicit nonhydrostatic solver in an atmospheric dynamical core.The NAS is designed to replace this solver,which can be incorporated into any hydrostatic models so that existing well-developed hydrostatic models can effectively serve for a longer time.Recent advances in machine learning(ML)provide a potential tool for capturing the main complicated nonlinear-nonhydrostatic relationship.In this study,an ML approach called a neural network(NN)was adopted to select leading input features and develop the NAS.The NNs were trained and evaluated with 12-day simulation results of dry baroclinic-wave tests by the Weather Research and Forecasting(WRF)model.The forward time difference of the nonhydrostatic tendency was used as the target variable,and the five selected features were the nonhydrostatic tendency at the last time step,and four hydrostatic variables at the current step including geopotential height,pressure in two different forms,and potential temperature,respectively.Finally,a practical NAS was developed with these features and trained layer by layer at a 20-km horizontal resolution,which can accurately reproduce the temporal variation and vertical distribution of the nonhydrostatic tendency.Corrected by the NN-based NAS,the improved hydrostatic solver at different horizontal resolutions can run stably for at least one month and effectively reduce most of the nonhydrostatic errors in terms of system bias,anomaly root-mean-square error,and the error of the wave spatial pattern,which proves the feasibility and superiority of this scheme. 展开更多
关键词 neural network nonhydrostatic alternative scheme atmospheric model dynamical core
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Surface engineering of P2-type cathode material targeting long-cycling and high-rate sodium-ion batteries
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作者 Jun Xiao Yang Xiao +11 位作者 Shijian wang Zefu Huang Jiayi Li Cheng Gong Guilai Zhang Bing Sun Hong Gao Huiqiao Li Xin Guo yong wang Hao Liu Guoxiu wang 《Journal of Energy Chemistry》 SCIE EI CAS CSCD 2024年第10期444-452,I0009,共10页
The widespread interest in layered P2-type Mn-based cathode materials for sodium-ion batteries(SIBs)stems from their cost-effectiveness and abundant resources.However,the inferior cycle stability and mediocre rate per... The widespread interest in layered P2-type Mn-based cathode materials for sodium-ion batteries(SIBs)stems from their cost-effectiveness and abundant resources.However,the inferior cycle stability and mediocre rate performance impede their further development in practical applications.Herein,we devised a wet chemical precipitation method to deposit an amorphous aluminum phosphate(AlPO_(4),denoted as AP)protective layer onto the surface of P2-type Na_(0.55)Ni_(0.1)Co_(0.7)Mn_(0.8)O_(2)(NCM@AP).The resulting NCM@5AP electrode,with a 5 wt%coating,exhibits extended cycle life(capacity retention of78.4%after 200 cycles at 100 mA g^(-1))and superior rate performance(98 mA h g^(-1)at 500 mA g^(-1))compared to pristine NCM.Moreover,our investigation provides comprehensive insights into the phase stability and active Na^(+)ion kinetics in the NCM@5AP composite electrode,shedding light on the underlying mechanisms responsible for the enhanced performance observed in the coated electrode. 展开更多
关键词 Layered metal oxides Sodium-ion batteries P2-type structure Surface engineering
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2种聚烯烃的水平流淌燃烧行为及熔体流变性
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作者 王勇 周奥辉 +2 位作者 李亚萍 段蕾 孙诗洋 《高分子材料科学与工程》 EI CAS CSCD 北大核心 2024年第6期92-98,共7页
聚合物熔融燃烧时会产生大量流滴熔体,严重影响燃烧行为和火灾危害,但是多数研究集中于垂直燃烧模式,仅少量研究探讨了几种生胶的水平燃烧行为。文中测定了聚乙烯和聚丙烯水平燃烧时的熔体流淌面积和质量损失速率,通过设计的锥形量热仪... 聚合物熔融燃烧时会产生大量流滴熔体,严重影响燃烧行为和火灾危害,但是多数研究集中于垂直燃烧模式,仅少量研究探讨了几种生胶的水平燃烧行为。文中测定了聚乙烯和聚丙烯水平燃烧时的熔体流淌面积和质量损失速率,通过设计的锥形量热仪样品盒收集了水平流淌熔体并表征其熔融温度和剪切黏度。研究发现,与熔体流动受限相比,聚乙烯和聚丙烯的水平流淌燃烧面积增大约10倍,最大燃烧速率增加超过1倍。在50kW/m2热辐射作用下,聚乙烯和聚丙烯在临近着火时就出现熔体流淌现象,且水平燃烧流淌熔体分别占到试样初始质量的58%和42%,与垂直燃烧滴落熔体质量占比相近,流淌熔体的熔融温度比原聚合物低6.2℃,黏流活化能比原聚合物分别减小34.4%和29.9%。 展开更多
关键词 锥形量热仪 熔体流淌 流变 聚乙烯 聚丙烯
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Efficient Monolithic Perovskite/Silicon Tandem Photovoltaics
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作者 yong wang Yu wang +1 位作者 Feng Gao Deren Yang 《Energy & Environmental Materials》 SCIE EI CAS CSCD 2024年第3期268-281,共14页
Tunable bandgaps make halide perovskites promising candidates for developing tandem solar cells(TSCs),a strategy to break the radiative limit of 33.7%for single-junction solar cells.Combining perovskites with market-d... Tunable bandgaps make halide perovskites promising candidates for developing tandem solar cells(TSCs),a strategy to break the radiative limit of 33.7%for single-junction solar cells.Combining perovskites with market-dominant crystalline silicon(c-Si)is particularly attractive;simple estimates based on the bandgap matching indicate that the efficiency limit in such tandem device is as high as 46%.However,state-of-the-art perovskite/c-Si TSCs only achieve an efficiency of~32.5%,implying significant challenges and also rich opportunities.In this review,we start with the operating mechanism and efficiency limit of TSCs,followed by systematical discussions on wide-bandgap perovskite front cells,interface selective contacts,and electrical interconnection layer,as well as photon management for highly efficient perovskite/c-Si TSCs.We highlight the challenges in this field and provide our understanding of future research directions toward highly efficient and stable large-scale wide-bandgap perovskite front cells for the commercialization of perovskite/c-Si TSCs. 展开更多
关键词 2-terminal electrical interconnection perovskite/silicon tandem photovoltaics photon management wide-bandgap perovskites
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ON MONOTONE TRAVELING WAVES FOR NICHOLSON'S BLOWFLIES EQUATION WITH DEGENERATE p-LAPLACIAN DIFFUSION
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作者 Rui HUANG yong wang Zhuo YIN 《Acta Mathematica Scientia》 SCIE CSCD 2024年第4期1550-1571,共22页
We study the existence and stability of monotone traveling wave solutions of Nicholson's blowflies equation with degenerate p-Laplacian diffusion.We prove the existence and nonexistence of non-decreasing smooth tr... We study the existence and stability of monotone traveling wave solutions of Nicholson's blowflies equation with degenerate p-Laplacian diffusion.We prove the existence and nonexistence of non-decreasing smooth traveling wave solutions by phase plane analysis methods.Moreover,we show the existence and regularity of an original solution via a compactness analysis.Finally,we prove the stability and exponential convergence rate of traveling waves by an approximated weighted energy method. 展开更多
关键词 degenerate diffusion P-LAPLACIAN traveling waves stability
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Silicon-based dielectric elastomer with amino-complexed hybrids towards high actuation performance
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作者 Zhengxing Dai Qingqing Liu +4 位作者 Xiaodong Qi Nan Zhang Ting Huang Jinghui Yang yong wang 《Nano Materials Science》 EI CAS CSCD 2024年第5期576-586,共11页
For improving the actuation performance at low electric fields of dielectric elastomers,achieving high dielectric constant(εr)and low modulus(Y)simultaneously has been targeted in the past decades,but there are few w... For improving the actuation performance at low electric fields of dielectric elastomers,achieving high dielectric constant(εr)and low modulus(Y)simultaneously has been targeted in the past decades,but there are few ways to accomplish both.In contrast to the classical strategies such as incorporating plasticizers or ceramic to prepare the silicon-based dielectric elastomers,here,blending an amino-complexed hybrid(polyethyleneimine(PEI)-Ag)with polydimethylsiloxane(PDMS)elastomer is reported as an alternative strategy to tailor theεr and Y.PEI-Ag not only exhibits excellent dielectric enhancement properties but also minimizes the PDMS crosslinking through amino-complexed reaction between PEI and Pt catalysts.The prepared dielectric elastomers have aεr of 7.2@10^(3)Hz and Y of 1.14 MPa,leading to an actuation strain of 22.27%at 35 V/μm.Hence,incorporating such novel hybrids based on dual amino-complexed effect on both matrix and particles sufficiently promotes the actuated performance of dielectric elastomers. 展开更多
关键词 Flexible composites Dielectric property Electro-mechanical behaviour AGNPS
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Spatial-and spin-resolution ARPES and magnetism beamline at SSRF
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作者 Fang‑Yuan Zhu Jie‑Feng Cao +10 位作者 Xiang‑Yu Meng Jun‑Qin Li Rui Yu Ya‑Mei wang Shan Qiao Bo Zhao Ming‑Zhu Zhang Zhong‑Kai Liu Mei‑Xiao wang yong wang Ren‑Zhong Tai 《Nuclear Science and Techniques》 SCIE EI CAS CSCD 2024年第8期23-37,共15页
The BL07U beamline is a new extreme ultraviolet and soft X-ray beamline housed in the Shanghai Synchrotron Radiation Facility. Beamlines are used in nano-resolved angle-resolved photoemission spectroscopy(nano-ARPES),... The BL07U beamline is a new extreme ultraviolet and soft X-ray beamline housed in the Shanghai Synchrotron Radiation Facility. Beamlines are used in nano-resolved angle-resolved photoemission spectroscopy(nano-ARPES), spin-resolved angle-resolved photoemission spectroscopy(spin-ARPES), X-ray magnetic circular dichroism spectroscopy, and X-ray magnetic linear dichroism spectroscopy for certain scientific research. The BL07U beamline, which is based on a pair of elliptical polarized undulators and a variable-included-angle plane-grating monochromator, delivers circularly or linear polarized X-rays within the energy range of 50–2000 eV. The beamline features two branches: One dedicated to nano-ARPES,which has a minimum spot size of only ~ 200 nm, and another branch comprising spin-ARPES, a vector magnetic field, and superconductive magnetic end-station. 展开更多
关键词 Soft X-ray beamline Nano-ARPES Spin-ARPES XMCD/XMLD
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