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Chinese Journal of Chemistry 2024年第1期42卷 43-47页

作者： Li Wang Renwei Xiao Jingyuan song Long-Sheng Zheng Qiwei Lang gen-Qiang chen Xumu Zhang Shenzhen Key Laboratory of Small Molecule Drug Discovery and Synthesis Department of Chemistryand Medi-PingshanSouthern University of Science and TechnologyShenzhenGuangdong 518000China Academy for Advanced Interdisciplinary Studies Southern Universityof Science and TechnologyShenzhenGuangdong 518000China Chemistry and Chemical Engineering Guangdong Laboratory ShantouGuangdong 515031China

Transition metal-catalyzed asymmetric transfer hydrogenation has been proven to be a powerful approach for the synthesis of chiral ***,a highly efficient and enantioselective transfer hydrogenation of dibenzoheptaheterocyclic ketones catalyzed by an arene-tethered TsDPEN-based Rh(ll)catalyst has been successfully developed,and a variety of dibenzoheptaheterocyclic ketones were reduced by a 1/1 mixture of formic acid and DBU(1,8-diazabicyclo[5.4.0]undec-7-ene)with high yields and *** this method,the asymmetric reduction of 7,8-difluorodibenzo[b,e]thiepin-11(6H)-one has been realized,providing the key intermediate of baloxavir marboxil with>99% yield and>99% ee at a substrate/catalyst molar ratio of 1000.

关键词： Asymmetric transfer hydrogenation Baloxavir Chiral alcohol Enantioselectivity Heterocyclic diaryl ketone Rhodium(Ⅱ)

Optimal Planning of Hybrid AC/DC Low-voltage Distribution Networks Considering DC Conversion of Three-phase Four-wire Low-voltage AC Systems

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Journal of Modern Power Systems and Clean Energy 2024年第1期12卷 141-153页

作者： Bo Zhang Lu Zhang Wei Tang gen Li chen Wang the College of Information and Electrical Engineering China Agricultural UniversityBeijing 100083China the Electric Energy Group Department of Engineering TechnologyTechnical University of Denmark(DTU)2750 BallerupDenmark the Power Distribution Technology Center State Grid Beijing Electric Power Research InstituteBeijing 100075China

The increasing integration of distributed household photovoltaics(PVs)and electric vehicles(EVs)may further ag gravate voltage violations and unbalance of low-voltage distribu tion networks(LVDNs).DC distribution networks can increase the accommodation of PVs and EVs and mitigate mutilple pow er quality problems by the flexible power regulation capability of voltage source *** paper proposes schemes to es tablish hybrid AC/DC LVDNs considering the conversion of the existing three-phase four-wire low-voltage AC systems to DC op *** characteristics and DC conversion constraints of typical LVDNs are *** addition,converter configura tions for typical LVDNs are proposed based on the three-phase four-wire characteristics and quantitative analysis of various DC ***,an optimal planning method of hybrid AC/DC LVDNs is proposed,which is modeled as a bi-level programming model considering the annual investments and three-phase *** are conducted to verify the effectiveness of the proposed optimal planning *** ulation results show that the proposed optimal planning method can increase the integration of PVs while simultaneously reduc ing issues related to voltage violation and unbalance.

关键词： Optimal planning low-voltage distribution net work three-phase unbalance DC conversion

Mn-doped LiFePO_(4)@C as a high-performance cathode material for lithium-ion batteries

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Particuology 2024年第7期90卷 418-428页

作者： Wenjing chen Fangxiang song Yumei Yang Qianlin chen School of Chemistry and Chemical Engineering Guizhou UniversityGuiyang550025China Collaborative Innovation Center of Guizhou Province for Efficient Utilization of Phosphorus and Fluorine Resources Guizhou UniversityGuiyang550025China

In this work,LiFe_(1-x)MnxPO_(4)@C(x=0,0.01,0.02,0.03)cathode materials were obtained by a simple co-precipitation method and heat treatment,and the influence of Mn-doped modification on the electrochemical performance of LiFePO_(4)@C cathode materials was *** show that by doping an appropriate amount of Mn,the cell volume became larger,and the electronic conductivity increased,which improved the Li+diffusion rate and thus its rate capability and cycle performance of Li-ion *** them,LiFe_(0.98)Mn_(0.02)PO_(4)@C showed superior lithium storage capability;the discharge capacity can reach 150.7 mAh g^(−1)at 0.1 *** cell could discharge up to 155.9 mAh g^(−1)at 1 C under high temperature at 45°C,which was higher than LiFePO_(4)@C(142 mAh g^(−1))under the same test *** discharge capacity of 1 C at room temperature was 139.9 mAh g^(−1),and the cycle stability was 95.9%after 200 *** showed that it had good rate capability and excellent cycle *** results indicate that Mn-doped LFP is a simple and effective strategy for developing high-performance cathode materials.

关键词： Mn-doped LiFePO_(4) Lithium-ion battery High temperature

Stereoselective synthesis of substituted 1,3-dienes from propargylic esters: electrophilic-metal or redox catalysis?

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Science China Chemistry 2024年第5期67卷 1384-1396页

作者： Mengfu Dai Liangliang song Liang-An chen Jiangsu Collaborative Innovation Center of Biomedical Functional Materials Jiangsu Key Laboratory of New Power BatteriesSchool of Chemistry and Materials ScienceNanjing Normal UniversityNanjing 210023China Jiangsu Co-Innovation Center of Efficient Processing and Utilization of Forest Resources International Innovation Center for Forest Chemicals and MaterialsCollege of Chemical EngineeringNanjing Forestry UniversityNanjing 210037China

1,3-Diene architectures are not only widely present in natural products, pharmaceuticals, and functional organic materials but also serve as versatile building blocks to furnish important functionalized molecules in synthetic chemistry due to conjugated repeating C=C units. Accordingly, various strategies to access substituted 1,3-dienes in a stereoselective manner have been developed. However, chemo-, regio-and stereoselective synthesis of highly substituted 1,3-dienes still remains elusive and challenging. Readily available propargylic esters have emerged as an appealing class of synthetic intermediates for accessing functionalized 1,3-dienes, especially challenging tri-or tetrasubstituted variants, via transition-metal catalysis, including electrophilic metal and redox neutral catalysis. This review, for the first time, systematically highlights recent advances in transitionmetal catalyzed synthesis of substituted 1,3-dienes from propargylic esters, discusses the mechanisms and synthetic utilities, and gives the remaining challenges and potential opportunities in this field.

关键词： 1 3-diene propargylic ester Lewis acid redox catalysis transition metal

Constraint Learning-based Optimal Power Dispatch for Active Distribution Networks with Extremely Imbalanced Data

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CSEE Journal of Power and Energy Systems 2024年第1期10卷 51-65页

作者： Yonghua song Ge chen Hongcai Zhang State Key Laboratory of Internet of Things for Smart City and Department of Electrical and Computer Engineering University of MacaoMacao 999078China School of Electrical and Computer Engineering Purdue UniversityWest LafayetteIN 47907 USA

Transition towards carbon-neutral power systems has necessitated optimization of power dispatch in active distribution networks(ADNs)to facilitate integration of distributed renewable *** to unavailability of network topology and line impedance in many distribution networks,physical model-based methods may not be applicable to their *** tackle this challenge,some studies have proposed constraint learning,which replicates physical models by training a neural network to evaluate feasibility of a decision(i.e.,whether a decision satisfies all critical constraints or not).To ensure accuracy of this trained neural network,training set should contain sufficient feasible and infeasible ***,since ADNs are mostly operated in a normal status,only very few historical samples are ***,the historical dataset is highly imbalanced,which poses a significant obstacle to neural network *** address this issue,we propose an enhanced constraint learning ***,it leverages constraint learning to train a neural network as surrogate of ADN's ***,it introduces Synthetic Minority Oversampling Technique to generate infeasible samples to mitigate imbalance of historical *** incorporating historical and synthetic samples into the training set,we can significantly improve accuracy of neural ***,we establish a trust region to constrain and thereafter enhance reliability of the *** confirm the benefits of the proposed method in achieving desirable optimality and feasibility while maintaining low computational complexity.

关键词： Deep learning demand response distribution networks imbalanced data optimal power flow

Preparation and characterization of high-reactivity explosive-based nano-boron microspheres

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Particuology 2024年第10期93卷 125-136页

作者： chen Dong Yi Wang Kanghui Jia Dan song Xiaolan song Chongwei An School of Materials Science and Engineering North University of ChinaTaiyuan030051China Jinxi Group Shanxi Jiangyang Chemical Co. Ltd.Taiyuan030051China China Ordnance Institute of Science and Technology Beijing100089China School of Environment and Safety Engineering North University of ChinaTaiyuan030051China

Boron nanoparticles,with their remarkably high gravimetric and volumetric calorific values,emerge as the most promising fuel in energetic ***,challenges such as susceptibility to oxidation,high ignition temperature,and low combustion efficiency have constrained their further *** this study,we fabricated high explosives based nano-boron microspheres with uniform size using the electrostatic spray method,in which the boron nanoparticles and high explosives(CL-20 or PETN)are closely bonded together by fluorinated polymer(F2602)and evenly *** results indicated that the microspheres exhibited high sphericity and showed an enhanced antioxidant *** addition of high-energy explosives not only reduced the thermal oxidation temperature of nano-boron powder within the microspheres but also significantly enhanced the pressurization ***,the microspheres with added high-energy explosives released more energy during the combustion *** to physically mixed samples,electrostatically sprayed microspheres with a uniform microstructure still exhibited higher ***,the design and synthesis of microspheres with controllable structures using the electrostatic spray method show promising application prospects.

关键词： Nano-boron CL-20 PETN Electrospraying Ignition and combustion

Geochemical modeling to aid experimental design for multiple isotope tracer studies of coupled dissolution and precipitation reaction kinetics

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Acta Geochimica 2024年第1期43卷 1-15页

作者： Mingkun chen Peng Lu Yongchen song chen Zhu Department of Earth and Atmospheric Sciences Indiana UniversityBloomingtonIN 47405USA School of Energy and Power Engineering Dalian University of TechnologyDalian 116024China EXPEC Advanced Research Center Saudi Aramco31311 DhahranSaudi Arabia

It is a challenge to make thorough but efficient experimental designs for the coupled mineral dissolution and precipitation studies in a multi-mineral system, because it is difficult to speculate the best experimental duration, optimal sampling schedule, effects of different experimental conditions, and how to maximize the experimental outputs prior to the actual experiments. Geochemical modeling is an efficient and effective tool to assist the experimental design by virtually running all scenarios of interest for the studied system and predicting the experimental outcomes. Here we demonstrated an example of geochemical modeling assisted experimental design of coupled labradorite dissolution and calcite and clayey mineral precipitation using multiple isotope tracers. In this study, labradorite(plagioclase) was chosen as the reactant because it is both a major component and one of the most reactive minerals in basalt. Following our isotope doping studies of single minerals in the last ten years, initial solutions in the simulations were doped withmultiple isotopes(e.g., Ca and Si). Geochemical modeling results show that the use of isotope tracers gives us orders of magnitude more sensitivity than the conventional method based on concentrations and allows us to decouple dissolution and precipitation reactions at near-equilibrium condition. The simulations suggest that the precise unidirectional dissolution rates can inform us which rate laws plagioclase dissolution has followed. Calcite precipitation occurred at near-equilibrium and the multiple isotope tracer experiments would provide near-equilibrium precipitation rates, which was a challenge for the conventional concentration-based experiments. In addition, whether the precipitation of clayey phases is the rate-limiting step in some multi-mineral systems will be revealed. Overall, the modeling results of multimineral reaction kinetics will improve the understanding of the coupled dissolution–precipitation in the mu

关键词： Kinetics Feldspar Isotope doping Near-equilibrium CO_(2)sequestration Basalt

Living donor liver transplantation in 43 children with biliary atresia: a single-center experience from the mainland of China

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Hepatobiliary & Pancreatic Diseases International 2012年第3期11卷 250-255页

作者： Jian-Jun Zhu, Qiang Xia, Jian-Jun Zhang, Feng Xue, Xiao-song chen, Qi-gen Li and Ning XuAuthor Department of Liver Surgery, Renji Hospital, Shanghai Jiaotong University School of Medicine, Shanghai 200127, China Department of Liver Surgery Renji Hospital Shanghai Jiaotong University School of Medicine Shanghai 200127 China

BACKGROUND: There is no large-cohort report on living donor liver transplantation (LDLT) for biliary atresia (BA) patients from the mainland of China. This single-center study describes our initial experience with 43 LDLTs for BA patients aged two years or younger. METHODS: In this study, the eligibility criteria were BA as the primary diagnosis and two years of age or younger. From October 2006 to December 2010, the clinical data of 43 LDLTs, including pre-operative evaluations, surgical techniques, postoperative complications and outcomes of donors and recipients, were retrospectively analyzed. RESULTS: Donor graft type was the left lateral segment with compatible ABO blood groups. Forty-three recipients were selected in this study. The median patient age at operation was 9 months (range 6-24), and the median body weight was 8 kg (range 5.7-12.5). Fourteen (32.6%) recipients received Kasai operations before liver transplantation. The overall one- and two-year cumulative survival rates for grafts and recipients were 81%, 81% and 76%, 76%, respectively. No donor mortality was encountered, with a minimal morbidity and no long- term sequelae. Nine out of 43 recipients died. Postoperative complications of recipients were biliary leakage and refluxing cholangitis (11/43, 25.6%), hepatic artery thrombosis (4, 9.3%), pulmonary infections (4, 9.3%), portal vein thrombosis (3, 7.0%), wound disruption (3, 7.0%), acute rejection (3, 7.0%), cytomegalovirus infection (2, 4.7%), and intra-abdominal bleeding (1, 2.3%).CONCLUSION: Despite the relatively low survival rates due to lack of experience initially, LDLT still provides encouraging outcomes for pediatric recipients with BA, even small children under two years old.

关键词： living donor liver transplantation biliary atresia children

Effect of nano-carbon black content on wetting phenomenon of molten steel and alumina-carbon ceramic filter substrates

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Journal of Iron and Steel Research International 2024年第8期31卷 1900-1913页

作者： Jin-wen song Wen Yan Zhe chen Ying Liu Shao-song Hong The State Key Laboratory of Refractories and Metallurgy Wuhan University of Science and TechnologyWuhan 430081HubeiChina National-provincial Joint Engineering Research Center of High Temperature Materials and Lining Technology Wuhan University of Science and TechnologyWuhan 430081HubeiChina Jiangsu Sheng Nai New Materials Co. Ltd.Taizhou 225503JiangsuChina

The effect of nano-carbon black content(O,8 and 12 wt.%)on the wettability of molten steel on Al_(2)O_(3)-C substrates was investigated by the sessile drop wetting method at 1500℃ under argon *** the beginning of the wetting experiment,the contact angle decreased with the increase in nano-carbon black *** the wetting experiment progressed,FeAl_(2)0_(4) layer and sheet Al_(2)O_(3) layer were found at the interface between the molten steel and the Al_(2)O_(3)-C substrates with O and 8 wt.% nano-carbon black content,and the contact angle deceased with *** the content of nano-carbon black was 12 wt.%,a large number of nano-Al_(2)O_(3) whiskers were observed,which made the contact angle between the molten steel and Al_(2)O_(3)-C substrate become *** on the scanning electron microscope and energy dispersive spectrometry results,the formation mechanism of FeAl2O4 layer and Al_(2)O_(3) layer and the interfacial reaction mechanism were proposed.

关键词： Contact angle Nano-carbon black Al_(2)O_(3)-C substrate Molten steel Interfacial reaction

Interpretation and characterization of rate of penetration intelligent prediction model

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Petroleum Science 2024年第1期21卷 582-596页

作者： Zhi-Jun Pei Xian-Zhi song Hai-Tao Wang Yi-Qi Shi Shou-Ceng Tian gen-Sheng Li College of Petroleum Engineering China University of Petroleum(Beijing)Beijing102249China State Key Laboratory of Petroleum Resources and Prospecting Beijing102249China Kunlun Digital Technology Co. Ltd.Beijing102206China

Accurate prediction of the rate of penetration(ROP)is significant for drilling *** the intelligent ROP prediction model based on fully connected neural networks(FNN)outperforms traditional ROP equations and machine learning algorithms,its lack of interpretability undermines its *** study proposes a novel interpretation and characterization method for the FNN ROP prediction model using the Rectified Linear Unit(ReLU)activation *** leveraging the derivative of the ReLU function,the FNN function calculation process is transformed into vector *** FNN model is linearly characterized through further simplification,enabling its interpretation and *** proposed method is applied in ROP prediction scenarios using drilling data from three vertical wells in the Tarim *** results demonstrate that the FNN ROP prediction model with ReLU as the activation function performs exceptionally *** relative activation frequency curve of hidden layer neurons aids in analyzing the overfitting of the FNN ROP model and determining drilling data *** the well sections with similar drilling data,averaging the weight parameters enables linear characterization of the FNN ROP prediction model,leading to the establishment of a corresponding linear representation ***,the quantitative analysis of each feature's influence on ROP facilitates the proposal of drilling parameter optimization schemes for the current well *** established linear characterization equation exhibits high precision,strong stability,and adaptability through the application and validation across multiple well sections.

关键词： Fully connected neural network Explainable artificial intelligence Rate of penetration ReLU active function Deep learning Machine learning