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Mechanisms of fracture propagation from multi-cluster using a phase field based HMD coupling model in fractured reservoir

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Petroleum Science 2024年第3期21卷 1829-1851页

作者： Yun-Jin Wang Bo Wang Hang Su Tu Chang Ren-Cheng Dong Li-Zhe Li Wei-Yu Tang ting-Xue jiang Fu-jian Zhou State Key Laboratory of Petroleum Resources and Engineering China University of Petroleum-BeijingBejing2249China China University of Petroleum-Beijing at Karamay Karamay834000XinjiangChina China National Oil and Gas Exploration and Development Corporation Ltd. Beijing100034China University of Texas at Austin United States SINOPEC Research Institute of Petroleum Engineering Beijing100101China

Natural fractures(NFs)are common in shale and tight reservoirs,where staged multi-cluster fracturing of horizontal wells is a prevalent technique for reservoir *** NFs and stress interference are recognized as significant factors affecting hydraulic fracture(HF)propagation,the combined influence of these factors remains poorly *** address this knowledge gap,a novel coupled hydromechanical-damage(HMD)model based on the phase field method is developed to investigate the propagation of multi-cluster HFs in fractured *** comprehensive energy functional and control functions are established,while incorporating dynamic fluid distribution between multiple perforation clusters and refined changes in rock mechanical parameters during hydraulic *** HMD coupled multi-cluster HF propagation model investigates various scenarios,including single HF and single NF,reservoir heterogeneity,single HF and NF clusters,and multi-cluster HFs with NF *** results show that the HMD coupling model can accurately capture the impact of approach angle(θ),stress difference and cementation strength on the interaction of HF and *** criterion of the open and cross zones is not *** NF angle(a)is not a decisive parameter to discriminate the *** to the relationship between approach angle(θ)and NF angle(a),the contact relationship of HF can be divided into three categories(θ=a,θa).The connected NF can increase the complexity of HF by inducing it to form branch fracture,resulting in a fractal dimension of HF as high as2.1280 at angles of±45°.Inter-fracture interference from the heel to the toe of HF shows the phenomenon of no,strong and weak ***,under the influence of NFs,distant HFs from the injection can become dominant ***,as a gradually increases,inter-fracture stress interference becomes the primary factor influencing HF propagation,gradually superseding the dominance of NF

关键词： HMD coupling Phase field Natural fracture Flow distribution Hydraulic fracturing Inter-fracture interference

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Dinitrophenyl-oxadiazole compounds:Design strategy,synthesis,and properties of a series of new melt-cast explosives

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Defence Technology（防务技术） 2024年第5期35卷 100-107页

作者： Bao-long Kuang ting-wei Wang Cong Li Mou Sun Qamar-un-Nisa Tariq Chao Zhang Zhi-ming Xie Zu-jia Lu jian-guo Zhang State Key Laboratory of Explosion Science and Technology Beijing Institute of TechnologyBeijing100081China China Wuzhou Engineering Group CO. LTD.Beijing 100053China

Melt-cast explosives are the most widely used energetic materials in military composite explosives,researchers have been unremittingly exploring high-energy and insensitive melt-cast *** this work,a series of dinitrophenyl-oxadiazole compounds were designed and *** compounds have an ideal low melting point(80-97℃),good detonation performance(detonation velocity D=6455-6971 m/s,detonation pressure P=18-19 GPa)and extreme insensitive nature(impact sensitivity≥60 J,friction sensitivity>360 N).All these compounds were well characterized by nuclear magnetic resonance,fourier transform infrared spectroscopy,elemental *** 2,3 were unambiguously confirmed by X-ray single crystal diffraction *** a result,their overall properties are superior to traditional melt-cast explosives trinitrotoluene(TNT)and dinitroanisole(DNAN)which may have excellent potential applications in insensitive melt-cast explosives.

关键词： Dinitrophenyl-oxadiazole Melt-cast explosive Low sensitivity

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Harvesting the Vibration Energy of CdS for High-Efficient Piezo-Photocatalysis Removal of U(Ⅵ):Roles of Shape Dependent and Piezoelectric Polarization

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Energy & Environmental Materials 2024年第5期7卷 391-403页

作者： Zhimin Dong Donglin Gao Zifan Li Haonan Pei Lin Xu jian Huang Xiaohong Cao Youqun Wang ting Wang Qianglin Wei Zhibin Zhang Yunhai Liu State Key Laboratory of Nuclear Resources and Environment East China University of Technology Institute of Geology Chinese Academy of Geological Sciences

Piezo-photocatalysis could coalesce the advantages of mechanical vibration and solar energy perfectly to achieve high-efficiency catalytic activity. Herein,the quintessential piezoelectric material CdS nanowires with different aspect ratios are precisely constructed and applied for piezo-photocatalytic reduction of U（Ⅵ） for the first time. The ultrasonic （60 kHz, 100 W） induces piezoelectric potential to generate a 0.57 eV A-1electric field, which is added to the direction of CdS （010） as a driving force to efficiently separate photogenerated charges. The alliance between piezoelectric effect and photocatalytic activity endows CdS NW-3 with the fastest piezophotocatalytic rate under ultrasonic vibration and 5 W LED irradiation, and the relevant rate constant (0.042 min-1) is about 12 and 53.8 times than that of LED and ultrasonication. More importantly, 93.74%of U（Ⅵ） could be removed from natural uranium mine wastewater. Therefore, this piezophotocatalysis system that reduces U（Ⅵ） to easily separable （UO2）O2·2H2O（s） provides valuable input for disposal applications of radioactive wastewater and broadens the horizons of nuclear energy utilization toward the advancement of carbon neutrality.

关键词： (UO2)O2·2H2O CdS nanowires piezo-photocatalytic piezo-potential U(VI)

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Enhancing solar-driven overall water splitting via both sacrifice and noble metal free photocatalysis: copper cluster/boron-doped carbon nitride catalysts

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Science China Chemistry 2024年第11期67卷 3886-3896页

作者： Yun-Dong Cao Yuxi Zhang jian Song Hong Liu Zhiyuan Song Lin-Lin Fan cai-Li Lv Guang-Gang Gao School of Materials Science and Engineering University of Jinan

The major impediment to the additional industrialization of water splitting is the high cost of the co-catalyst made of noble metals and the sacrificial reagent. A binary photocatalytic system, consisting of B-doped g-C3N4nanosheets(Cu20@BCN-X) and atomically accurate copper clusters, is designed in this study. The copper clusters serve as co-catalysts for H2evolution and exhibit Pt-like activity, whereas the nanosheets serve as carriers and semiconductor components for O2evolution. Such binary system, created using simple techniques, demonstrates hydrogen bonding interactions that promote synergistic effects and efficient binding and charge transfer across the interface between the two components. Band position manipulation of carbon nitride nanosheets demonstrates a Z-scheme charge transfer mechanism between the nanosheets and copper clusters. This photocatalytic system can accomplish the photocatalytic overall water splitting process(259.9 μmol g-1h-1of H2and 129.4 μmol g-1h-1of O2) without using sacrificial agents or noble metal co-catalysts. This work lays the foundation for the design of overall water splitting catalysts by precisely manipulating the energy levels, and it also paves the way for commercialized photocatalytic catalysts that do not require noble metals or sacrificial chemicals.

关键词： copper clusters band modulation photocatalysts water splitting

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Defect-induced synthesis of nanoscale hierarchically porous metal-organic frameworks with tunable porosity for enhanced volatile organic compound adsorption

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Nano Materials Science 2024年第4期6卷 467-474页

作者： Kuan Liang Weibiao Guo Linmei Li Huidong cai Haiqi Zhang Jingjing Li Feng Xu jian Yan Daofei Lv Hongxia Xi Chongxiong Duan Guangdong Provincial Key Laboratory of Intelligent Food Manufacturing Foshan University School of Materials Science and Hydrogen Engineering Foshan University School of Chemistry and Chemical Engineering South China University of Technology School of Environmental and Chemical Engineering Foshan University

Nanoscale hierarchically porous metal-organic frameworks （NH-MOFs） synergistically combine the advantages of nanoscale MOFs and hierarchically porous MOFs,resulting in remarkable characteristics such as increased specific surface area,greater porosity,and enhanced exposure of active ***,nanoscale hierarchically porous UIO-66 （UIO-66＿X） was synthesized using a defect-induced strategy that employed ethylene diamine tetraacetic acid （EDTA） as a *** introduced EDTA occupies the coordination sites of organic ligands,promoting the formation and growth of UIO-66 crystal nuclei and inducing defects during *** as-synthesized UIO-66＿X crystals exhibit a uniform distribution with an average size of approximately 100 *** addition,the total pore volume attains a remarkable value of 0.95 cm3g-1,with mesopores constituting 36.8%of the ***,the porosities of UIO-66＿X can be easily tuned by controlling the molar ratio of EDTA/Zr4+.In addition,the as-synthesized UIO-66＿X exhibits excellent adsorption capacities for n-hexane (344 mg g-1) and pxylene (218 mg g-1),which are 44.5%and 27.5%higher than those of conventional UIO-66,***,the adsorption behavior of n-hexane and p-xylene molecules in UIO-66＿X was investigated using density functional theory simulations.

关键词： Nanoscale hierarchically porous MOFs Tunable porosities Enhanced VOC adsorption

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Integrated analyses of transcriptomics and network pharmacology reveal leukocyte characteristics and functional changes in subthreshold depression,elucidating the curative mechanism of Danzhi Xiaoyao powder

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Journal of Traditional Chinese Medical Sciences 2024年第1期11卷 3-20页

作者： Kunyu Li Leiming You jianhua Zhen Guangrui Huang ting Wang Yanan cai Yunan Zhang Anlong Xu School of Life Sciences Bejing University of Chinese MedicineBeijing 102488China School of Life Sciences Sun Yat-Sen UniversityGuangzhou 510006Chin

Objective:To investigate the molecular mechanism and identify potential drugs for subthreshold depression(SD),and elucidate the detalied mechanism of Danzhi Xiaoyao powder(DZXY)in ***:Using RNA-sequencing,we identified differentially expressed genes(DEGs)in leukocytes of SD compared to healthy controls,deciphered their functions and pathways,and identified the hub genes of *** also assessed changes in leukocyte transcription factor activity in patients with SD using the TELis *** Connectivity Map database was retrieved to screen candidate drugs for *** on network pharmacology,we elucidated the"multi-component,multi-target,and multi-pathway"mechanism of DZXY in the treatment of ***:We identified 1080 DEGs(padj<0.05 and|log2(fold change)l≥1&protein coding)in the leukocytes of patients with *** DEGs,including hub genes,were primarily involved in immune and inflammatory response-related *** factor activity analysis revealed similarities between the leukocyte transcriptome profile in SD and the conserved transcriptional response to adversities in immune *** Map analysis identified 28 potential drugs for SD treatment,particularly SB-202190 and *** the"Direct Compounds-Direct Targets-Pathways"network for DZXY and SD revealed the curative mechanisms of DZXY in SD,primarily including inflammatory response,lipid metabolism,immune response,and other ***:These results provide new insights into the characteristics and functional changes of leukocytes in SD,partially illustrate the pathogenesis of SD,and suggest potential drugs for *** curative mechanisms of DZXY in SD are also partially elucidated.

关键词： Subthreshold depression Leukocyte mRNAbiomarker CTRA Transcription factor activity CMap Danzhi Xiaoyaopowder Networkpharmacology

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含孔洞炸药晶体HMX冲击响应的分子动力学模拟

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含能材料 2024年第1期32卷 65-75页

作者：周婷婷楼建锋北京应用物理与计算数学研究所北京100094

动载荷下炸药晶体缺陷与热点形成的关联是当前含能材料领域的研究热点之一,理解热点形成机制及其对炸药起爆和感度的影响对于炸药安全性评估和研制安全弹药至关重要。本研究采用ReaxFF反应力场和分子动力学方法,对含圆柱形孔洞的炸药单... 详细信息

动载荷下炸药晶体缺陷与热点形成的关联是当前含能材料领域的研究热点之一,理解热点形成机制及其对炸药起爆和感度的影响对于炸药安全性评估和研制安全弹药至关重要。本研究采用ReaxFF反应力场和分子动力学方法,对含圆柱形孔洞的炸药单晶奥克托金(HMX)在冲击载荷下的动态响应进行了研究,并探究了孔洞尺寸和双孔洞的影响。结果表明,冲击载荷下孔洞的塌缩过程分为3个阶段,即孔洞上游的塑性变形、上游原子向孔洞中心和下游运动形成流动原子、流动原子与下游碰撞。热点形成的主要机制是流动原子与下游碰撞使得动能转换为热能导致温度快速升高。热点的高温诱发了局部化学反应,HMX分子中N─NO2键断裂生成NO2是主要的初始反应机制。圆柱形孔洞的塌缩过程和热点形成机制与球形孔洞是相似的,但圆柱形孔洞的汇聚效应更弱、形成的流动原子速度更低,导致热点温度显著降低、化学反应更弱。此外,圆柱形孔洞在塌缩过程中在其周围形成了剪切带,这在球形孔洞中没有出现。随着孔洞尺寸的增大,流动原子的速度提高、剪切带变宽、热点温度升高且面积增大,进而引发了更剧烈的化学反应。对于沿冲击方向排布相距一个孔洞半径的双孔洞,孔洞塌缩过程与单孔洞是类似的,但由于冲击波在传过上游孔洞后压力有所降低,导致下游孔洞在塌缩过程中形成的流动原子速度更小、热点温度更低。本研究有助于深入理解晶体缺陷对炸药热点形成与起爆机理的作用,为宏观理论建模提供物理机制与规律认识。

关键词：炸药孔洞热点化学反应分子动力学

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Endoscopic detection and diagnostic strategies for minute gastric cancer:A real-world observational study

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World Journal of Gastrointestinal Oncology 2024年第8期16卷 3529-3538页

作者： Xiao-Wei Ji Jie Lin Yan-ting Wang Jing-Jing Ruan Jing-Hong Xu Kai Song jian-Shan Mao Department of Gastroenterology The Second Affiliated HospitalZhejiang University School of MedicineHangzhou 310009Zhejiang ProvinceChina Department of Pathology The Second Affiliated HospitalZhejiang University School of MedicineHangzhou 310009Zhejiang ProvinceChina

BACKGROUND Minute gastric cancers(MGCs)have a favorable prognosis,but they are too small to be detected by endoscopy,with a maximum diameter≤5 *** To explore endoscopic detection and diagnostic strategies for *** This was a real-world observational *** endoscopic and clinicopathological parameters of 191 MGCs between January 2015 and December 2022 were retrospectively *** discoverable opportunity and typical neoplastic features were emphatically *** All MGCs in our study were of a single pathological type,97.38%(186/191)of which were differentiated-type *** light endoscopy(WLE)detected 84.29%(161/191)of MGCs,and the most common morphology of MGCs found by WLE was ***-band imaging(NBI)secondary observation detected 14.14%(27/191)of MGCs,and the most common morphology of MGCs found by NBI was *** three MGCs were detected by indigo carmine third *** a well-demarcated border lesion exhibited a typical neoplastic color,such as yellowish-red or whitish under WLE and brownish under NBI,MGCs should be *** proportion with high diagnostic confidence by magnifying endoscopy with NBI(ME-NBI)was significantly higher than the proportion with low diagnostic confidence and the only visible groups(94.19%>56.92%>32.50%,P<0.001).CONCLUSION WLE combined with NBI and indigo carmine are helpful for detection of MGCs.A clear demarcation line combined with a typical neoplastic color using nonmagnifying observation is sufficient for diagnosis of *** improves the endoscopic diagnostic confidence of MGCs.

关键词： Minute gastric cancer White light endoscopy Narrow-band imaging endoscopy Indigo carmine Magnifying endoscopy Detection Diagnosis

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Effectiveness and tolerability of programmed cell death protein-1 inhibitor+chemotherapy compared to chemotherapy for upper gastrointestinal tract cancers

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World Journal of Gastrointestinal Oncology 2024年第4期16卷 1613-1625页

作者： Xiao-Min Zhang ting Yang Ying-Ying Xu Bao-Zhong Li Wei Shen Wen-Qing Hu cai-Wen Yan Liang Zong Department of Central Laboratory Changzhi People’s HospitalThe Affiliated Hospital of Changzhi Medical CollegeChangzhi 046000Shanxi ProvinceChina Department of Gastrointestinal Surgery Yizheng People’s HospitalThe Affiliated Hospital of Yangzhou UniversityYangzhou 225000Jiangsu ProvinceChina Department of General Surgery Anyang Tumor HospitalAnyang 455000Henan ProvinceChina Department of General Surgery Wuxi People’s Hospital Affiliated to Nanjing Medical UniversityWuxi 214023Jiangsu ProvinceChina Department of Gastrointestinal Surgery Changzhi People’s HospitalThe Affiliated Hospital of Changzhi Medical CollegeChangzhi 046000Shanxi ProvinceChina Department of Gastroenterology Changzhi People’s HospitalThe Affiliated Hospital of Changzhi Medical CollegeChangzhi 046000Shanxi ProvinceChina

BACKGROUND The combination of programmed cell death protein-1(PD-1)inhibitor and che-motherapy is approved as a standard first-or second-line treatment in patients with advanced oesophageal or gastric ***,it is unclear whether this combination is superior to chemotherapy *** To assess the comparative effectiveness and tolerability of combining PD-1 inhibitors with chemotherapy vs chemotherapy alone in patients with advanced gastric cancer,gastroesophageal junction(GEJ)cancer,or oesophageal *** We searched the PubMed and Embase databases for studies that compared the efficacy and tolerance of PD-1 inhibitors in combination with chemotherapy vs chemotherapy alone in patients with advanced oesophageal or gastric *** employed either random or fixed models to analyze the outcomes of each clinical trial,en-compassing data on overall survival(OS),progression-free survival(PFS),objective response rate,and adverse events(AEs).RESULTS Nine phase 3 clinical trials(7016 advanced oesophageal and gastric cancer patients)met the inclusion *** meta-analysis demonstrated that the pooled PD-1 inhibitor+chemotherapy group had a significantly longer OS than the chemotherapy-alone group[hazard ratio(HR)=0.76,95%confidence interval(CI):0.71-0.81];the pooled PFS result was consistent with that of OS(HR=0.67,95%CI:0.61-0.74).The count of patients achieving an objective response in the PD-1 inhibitor+chemotherapy group surpassed that of the chemotherapy-alone group[odds ratio(OR)=1.86,95%CI:1.59-2.18].AE incidence was also higher in the combination-therapy group than in the chemotherapy-alone group,regardless of whether≥grade 3 only(OR=1.30,95%CI:1.07-1.57)or all AE grades(OR=1.88,95%CI:1.39-2.54)were *** performed a subgroup analysis based on the programmed death-ligand 1(PD-L1)combined positive score(CPS)and noted extended OS and PFS durations within the CPS≥1,CPS≥5,and CPS≥10 subgroups of the PD-1 inhibitor+chemotherapy ***

关键词： Programmed cell death protein-1 inhibitor Chemotherapy Oesophageal squamous cell carcinoma Gastric/gastroesophageal junction adenocarcinoma Overall survival Progression-free survival Objective response rate Adverse event

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Surface treatment of GaN nanowires for enhanced photoelectrochemical water-splitting

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Chinese Chemical Letters 2024年第9期35卷 398-402页

作者： Wenhao Chen jian Du Hanbin Zhang Hancheng Wang Kaicheng Xu Zhujun Gao Jiaming Tong Jin Wang Junjun Xue ting Zhi Longlu Wang College of Integrated Circuit Science and Engineering Nanjing University of Posts and TelecommunicationsNanjing 210023China College of Electronic and Optical Engineering&College of Flexible Electronics(Future Technology) Nanjing University of Posts and TelecommunicationsNanjing 210023China

High-efficiency hydrogen production through photoelectrochemical(PEC)water splitting has emerged as a promising solution to address current global energy challenges.Ⅲ-nitride semiconductor photoelectrodes with nanostructures have demonstrated great potential in the near future due to their high light absorption,tunable direct band gap,and strong physicochemical ***,several issues,including surface trapping centers,surface Fermi level pinning,and surface band bending,need to be *** this work,enhanced photovoltaic properties have been achieved using gallium nitride(GaN)nanowires(NWs)photoelectrodes by adopting an alkaline solution surface treatment method to reduce the surface *** was found that surface oxides on NWs can be removed by an alkaline solution treatment without changing the surface morphology through X-ray photoelectron spectroscopy(XPS),scanning electron microscopy(SEM)and other characterization *** findings provide new insights to the development of high-efficiency photoelectrodes for new energy source applications.

关键词： Water splitting Photoelectrochemical cells Gallium nitride Surface treatment Nano-architectures

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