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Adsorption and sensing characteristics of insulating gas C4f7N on 3d late transition metal-phthalocyanine:Theoretical and experimental study

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High Voltage 2024年第4期9卷 870-878页

作者： Dachang Chen Ziang Zheng Cong Zhang Yi Luo song xiao Qing Miao Ke Liu Beibei xiao school of Electrical and Electronic Engineering Wuhan Polytechnic UniversityWuhanChina Beijing International s&T Cooperation Base for Plasma science and Energy Conversion Institute of Electrical EngineeringChinese Academy of SciencesBeijingChina school of Electrical Engineering and Automation Wuhan UniversityWuhanChina school of Energy and Power Engineering Jiangsu University of Science and TechnologyZhenjiangChina

Heptafluoroisobutyronitrile(C_(4)f_(7)N)is being considered as a promising alternative to the greenhouse gas sf6 in the electrical ***,its biotoxicity necessitates the development of gas sensing technology to detect leaked C_(4)f_(7)N.A combination of density functional theory and experiments was employed to evaluate the adsorption and sensing performance of different metal-phthalocyanines as potential sensing materials for C_(4)f_(7)N *** study included exploring adsorption configurations with adsorption energies,electron transfer,and adsorption distance,as well as comparisons of electronic properties,electron distribution,and density of states(DOs)among the ***,gas sensing experiments were conducted using different MPcs to detect 25-100 ppm C_(4)f_(7)*** results revealed that Mn-Pc,fe-Pc,Co-Pc,and Zn-Pc exhibited considerable chemical interactions,while Ni-Pc and Cu-Pc showed weaker adsorption *** findings were further elucidated based on the electron density and DOs of atomic ***,gas sensing experiments indicated that Co-Pc demonstrated a higher response compared to fe-Pc at the same concentration of C_(4)f_(7)***,the theoretical and experimental insights offer valuable guidance for C_(4)f_(7)N detection and provide a systematic approach to screen and explore organometallic polymer-based gas sensors applicable in various fields.

关键词： adsorption phthalocyanine Adsorption

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All-electron basis sets for H to Xe specific for ZORA calculations:Applications in atoms and molecules

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Chinese Physics B 2024年第8期33卷 238-246页

作者： C.s.Gomes f.E.Jorge A.Canal Neto Departamento de fisica Universidade Federal do Espirito Santo29075-910 VitoriaESBrazil Departamento de fisica Instituto de Ciencias Exatas e BiologicasUniversidade Federal de Ouro Preto Campus Universitario Morro do Cruzeiro35402-136 Ouro PretoMGBrazil

A segmented basis set of quadruple zeta valence quality plus polarization functions(QZP)for H through Xe was developed to be used in conjunction with the ZORA *** set was augmented with diffuse functions to describe electrons farther away from the nuclei *** the ZORA-CCsD(T)/QZP-ZORA theoretical model,atomic ionization energies and bond lengths,harmonic vibrational frequencies,and atomization energies of some molecules were *** addition of core-valence corrections has been shown to improve the agreement between theoretical and experimental results for molecular *** atomization energies,a similar observation emerges when considering spin-orbit *** the augmented QZP-ZORA set,static mean dipole polarizabilities of a set of atoms were calculated and compared with previously published recommended and experimental *** evaluations of the ZORA and Douglas–Kroll–Hess Hamiltonians were made for each property studied.

关键词： QZP-ZORA and AQZP-ZORA basis sets elements from H to Xe CCsD(T)method atomic and molecular properties

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Adsorption of yttrium(Y^(3+)) and concentration of rare earth elements from phosphogypsum using chitin and chitin aerogel

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Journal of Rare Earths 2024年第4期42卷 775-782页

作者： Glaydson s.dos Reis Diana Pinto sabrina f.Lütke Eder C.Lima Luis f.O.silva Irineu A.s.De Brum Guilherme L.Dotto Department of forest Biomaterials and Technology Biomass Technology Centre Swedish University of Agricultural SciencesUmeaE13Swedn Universidad De La Costa Calle 58#55-66080002BarranquillaAtlanticoColombia Research Group on Adsorptive and Catalytic Process Engineering(ENGEPAC) Federal University of Santa MariaAv.Roraima100079705900Santa MariaRSBrazil Institute of Chemistry Federal University of Rio Grande do Sul90040060Porto AlegreBrazil

Chitin powder and chitin-aerogel were prepared from shrimp wastes and used to uptake Y^(3+)from aqueous solutions and concentrate this rare earth element from phosphogypsum(PG).Chitin aerogel displays a specific surface area of 945 m^(2)/g,while chitin powder is 3.6 m^(2)/g,which largely influences its adsorption *** the adsorption in synthetic solutions,the effect of pH on Y^(3+)removal is strong for chitin powder *** contrast,no big pH influence was detected for chitin *** interactions and chelation can highlight the proposed mechanism of Y^(3+)on chitin adsorbents for the powder and ***,in addition to these interactions,pore filling/pore diffusion is the main mechanism of Y^(3+)removal in the chitin *** aerogel is efficient in concentrating 8 times the Y^(3+)from PG,a very complex *** complex chitin aerogel-Y^(3+)can be a secondary source of rare earth elements for other applications.

关键词： Rare earths sustainable material Chitin powder Chitin porous aerogel Yttrium adsorption and recovery

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Research on performance optimization of virtual data space across WAN

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frontiers of Computer science 2024年第6期18卷 186505-186505页

作者： HUO Jiantong HUO Zhisheng xiao Limin HE Zhenxue state Key Laboratory of software Development Environment Beihang University school of Computer science and Engineering Beihang University High Performance Computing Center Beihang University Hebei Key Laboratory of Agricultural Big Data Hebei Agricultural University

for the high-performance computing in a WAN environment, the geographical locations of national supercomputing centers are scattered and the network topology is complex, so it is difficult to form a unified view of resources. To aggregate the widely dispersed storage resources of national supercomputing centers in China, we have previously proposed a global virtual data space named GVDs in the project of “High Performance Computing Virtual Data space”, a part of the National Key Research and Development Program of China. The GVDs enables large-scale applications of the high-performance computing to run efficiently across WAN. However, the applications running on the GVDs are often data-intensive, requiring large amounts of data from multiple supercomputing centers across WANs. In this regard, the GVDs suffers from performance bottlenecks in data migration and access across WANs. To solve the above-mentioned problem, this paper proposes a performance optimization framework of GVDs including the multitask-oriented data migration method and the request access-aware IO proxy resource allocation strategy. In a WAN environment, the framework proposed in this paper can make an efficient migration decision based on the amount of migrated data and the number of multiple data sources, guaranteeing lower average migration latency when multiple data migration tasks are running in parallel. In addition, it can ensure that the thread resource of the IO proxy node is fairly allocated among different types of requests (the IO proxy is a module of GVDs), so as to improve the application’s performance across WANs. The experimental results show that the framework can effectively reduce the average data access delay of GVDs while improving the performance of the application greatly.

关键词： storage aggregation across WANs large-scale applications GVDs data migration allocation of IO proxy resource

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RepBoTNet-CEsA:An Alzheimer’s Disease Computer Aided Diagnosis Method Using structural Reparameterization BoTNet and Cubic Embedding self Attention

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Computers, Materials & Continua 2024年第5期79卷 2879-2905页

作者： Xiabin Zhang Zhongyi Hu Lei xiao Hui Huang College of Computer science and Artificial Intelligence Wenzhou UniversityWenzhou325035China Key Laboratory of Intelligence Image Processing and Analysis Wenzhou UniversityWenzhou325035China

Various deep learning models have been proposed for the accurate assisted diagnosis of early-stage Alzheimer’s disease(AD).Most studies predominantly employ Convolutional Neural Networks(CNNs),which focus solely on local features,thus encountering difficulties in handling global *** contrast to natural images,structural Magnetic Resonance Imaging(sMRI)images exhibit a higher number of channel ***,during the Position Embedding stage ofMulti Head self Attention(MHsA),the coded information related to the channel dimension is *** tackle these issues,we propose theRepBoTNet-CEsA network,an advanced AD-aided diagnostic model that is capable of learning local and global features *** combines the advantages of CNN networks in capturing local information and Transformer networks in integrating global information,reducing computational costs while achieving excellent classification ***,it uses the Cubic Embedding self Attention(CEsA)proposed in this paper to incorporate the channel code information,enhancing the classification performance within the Transformer ***,the RepBoTNet-CEsA performs well in various AD-aided diagnosis tasks,with an accuracy of 96.58%,precision of 97.26%,and recall of 96.23%in the AD/NC task;an accuracy of 92.75%,precision of 92.84%,and recall of 93.18%in the EMCI/NC task;and an accuracy of 80.97%,precision of 83.86%,and recall of 80.91%in the AD/EMCI/LMCI/NC *** demonstrates that RepBoTNet-CEsA delivers outstanding outcomes in various AD-aided diagnostic ***,our study has shown that MHsA exhibits superior performance compared to conventional attention mechanisms in enhancing ResNet ***,the Deeper RepBoTNet-CEsA network fails to make further progress in AD-aided diagnostic tasks.

关键词： Alzheimer CNN structural reparameterization multi head self attention computer aided diagnosis

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Towards efficient strain engineering of 2D materials:A four-points bending approach for compressive strain

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Nano Research 2024年第6期17卷 5317-5325页

作者： Hao Li félix Carrascoso Ana Borrás Gloria P.Moreno francisco J.Aparicio Ángel Barranco Andrés Castellanos Gómez Campus de Cantoblanco Instituto de Ciencia de Materiales de MadridC.Sor Juana Inés de la Cruz328049 MadridSpain Nanotechnology on surfaces and Plasma Lab Instituto de Ciencia de Materiales de Sevilla(CSIC-Universidad de Sevilla).C/Americo Vespucio 49E-41092 SevilleSpain Departamento de física Aplicada I Escuela Politécnica SuperiorUniversidad de Sevillac/Virgen deÁfrica 7E-41011 SevilleSpain

strain engineering,as a powerful strategy to tune the optical and electrical properties of two-dimensional(2D)materials by deforming their crystal lattice,has attracted significant interest in recent years.2D materials can sustain ultra-high strains,even up to 10%,due to the lack of dangling bonds on their surface,making them ideal brittle *** remarkable mechanical resilience,together with a strong strain-tunable band structure,endows 2D materials with a broad optical and electrical response upon ***,strain engineering based on 2D materials is restricted by their nanoscale and strain quantification *** this study,we have modified a homebuilt three-points bending apparatus to transform it into a four-points bending apparatus that allows for the application of both compressive and tensile strains on 2D *** approach allows for the efficient and reproducible construction of a strain system and minimizes the buckling effect caused by the van der Waals interaction by adamantane encapsulation *** results demonstrate the feasibility of introducing compressive strain on 2D materials and the potential for tuning their optical and physical properties through this approach.

关键词： uniaxial compressive strain polymer encapsulation differential reflectance spectroscopy exciton tunability

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Insulin therapy in type 2 diabetes: Insights into clinical efficacy, patient-reported outcomes, and adherence challenges

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World Journal of Diabetes 2024年第5期15卷 828-852页

作者： Mahmoud Emad-Eldin Gehan f Balata Eman A Elshorbagy Mona s Hamed Mohamed s Attia Department of Pharmacy Practice Faculty of PharmacyZagazig UniversityZagazig HFQM+872Al-Sharqia GovernorateEgypt Department of Pharmacy Practice Faculty of PharmacyHeliopolis UniversityCairo 44519Egypt Department of Pharmaceutics Faculty of PharmacyZagazig UniversityZagazig 44519Al-Sharqia GovernorateEgypt Department of Internal Medicine Faculty of MedicineZagazig UniversityZagazig 44519Al-Sharqia GovernorateEgypt Department of Community at faculty of Medicine Zagazig UniversityZagazig 44519Al-Sharqia GovernorateEgypt

Insulin therapy plays a crucial role in the management of type 2 diabetes as the disease *** the past century,insulin formulations have undergone significant modifications and bioengineering,resulting in a diverse range of available insulin *** products show distinct pharmacokinetic and pharmacodynamic ***,various insulin regimens have em-erged for the management of type 2 diabetes,including premixed formulations and combinations of basal and bolus *** utilization of different insulin regimens yields disparate clinical outcomes,adverse events,and,notably,patient-reported outcomes(PROs).PROs provide valuable insights from the patient’s perspective,serving as a valuable mine of information for enhancing healthcare and informing clinical *** to insulin therapy,a critical patient-reported outcome,significantly affects clinical outcomes and is influenced by multiple *** review provides insights into the clinical effectiveness of various insulin preparations,PROs,and factors impacting insulin therapy adherence,with the aim of enhancing healthcare practices and informing clinical decisions for individuals with type 2 diabetes.

关键词： Adherence Diabetes Insulin Patient-reported outcomes Pharmacokinetic Pharmacodynamic

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A Comprehensive Review on Charging Topologies and Power Electronic Converter solutions for Electric Vehicles

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Journal of Modern Power systems and Clean Energy 2024年第3期12卷 675-694页

作者： Abdelfatah Ali Hossam H.H.Mousa Mostafa f.shaaban Maher A.Azzouz Ahmed s.A.Awad the Department of Electrical Engineering American University of Sharjah26666 SharjahUnited Arab Emirates the Department of Electrical Engineering South Valley University83523 QenaEgypt the Department of Electrical and Computer Engineering University of WindsorWindsorON N9B 3P4 Canada Electrical Engineering Department Qatar UniversityDoha 2713Qatar Department of Electrical and Computer Engineering Sultan Qaboos UniversityMuscat123Oman

Electric vehicles(EVs)are becoming more popular worldwide due to environmental concerns,fuel security,and price *** performance of EVs relies on the energy stored in their batteries,which can be charged using either AC(slow)or DC(fast)***,EVs can also be used as mobile power storage devices using vehicle-to-grid(V2G)*** electronic converters(PECs)have a constructive role in EV applications,both in charging EVs and in ***,this paper comprehensively investigates the state of the art of EV charging topologies and PEC solutions for EV *** examines PECs from the point of view of their classifications,configurations,control approaches,and future research prospects and their impacts on power *** can be classified into various topologies:DC-DC converters,AC-DC converters,DC-AC converters,and AC-AC *** address the limitations of traditional DC-DC converters such as switching losses,size,and high-electromagnetic interference(EMI),resonant converters and multiport converters are being used in high-voltage EV ***,power-train converters have been modified for high-efficiency and reliability in EV *** paper offers an overview of charging topologies,PECs,challenges with solutions,and future trends in the field of the EV charging station applications.

关键词： Charging station charging topology electric vehicle power electronic converter vehicle-to-grid

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The asymptotic behavior for a binary alloy in energy and material science:The unified method and its applications

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Journal of Ocean Engineering and science 2024年第4期9卷 373-378页

作者： M.Adel K.Aldwoah f.Alahmadi M.s.Osman Department of Mathematics Faculty of ScienceIslamic University of MadinahMedinaSaudi Arabia Department of Mathematics Faculty of ScienceCairo UniversityGiza 12613Egypt

The Cahn-Hilliard system was proposed to the first time by Chan and Hilliard in *** model(or system of equations)has intrinsic participation energy and materials sciences and depicts significant characteristics of two phase systems relating to the procedures of phase separation when the temperature is *** instance,it can be noticed when a binary alloy(“Aluminum+Zinc”or“Iron+Chromium”)is cooled down *** this case,partially or totally nucleation(nucleation means the appearance of nuclides in the material)is observed:the homogeneous material in the initial state gradually turns into inhomogeneous,giving rise to a very accurate dispersive ***,when the time scale is slower the microstructure becomes *** this work,to the first time,the unified method is presented to investigate some physical interpretations for the solutions of the Cahn-Hilliard system when its coefficients varying with time,and to show how phase separation of one or two components and their concentrations occurs dynamically in the ***,2D and 3D plots are introduced to add more comprehensive study which help to understand the physical phenomena of this *** technique applied in this analysis is powerful and efficient,as evidenced by the computational work and *** technique can also solve a large number of higher-order evolution equations.

关键词： Cahn-Hilliard system Traveling wave solutions The unified method Variable coefficients

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RPLP0/TBP are the most stable reference genes for human dental pulp stem cells under osteogenic differentiation

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World Journal of stem Cells 2024年第6期16卷 656-669页

作者： Daniel B ferreira Leticia M Gasparoni Cristiane f Bronzeri Katiucia B s Paiva Laboratory of Extracellular Matrix Biology and Cellular Interaction Department of AnatomyInstitute of Biomedical SciencesUniversity of São PauloSão Paulo 05508-000São PauloBrazil

BACKGROUND Validation of the reference gene(RG)stability during experimental analyses is essential for correct quantitative real-time polymerase chain reaction(RT-qPCR)data ***,in an unreliable way,several studies use genes involved in essential cellular functions[glyceraldehyde-3-phosphate dehydro-genase(GAPDH),18s rRNA,andβ-actin]without paying attention to whether they are suitable for such experimental conditions or the reason for choosing such ***,such studies use only one gene when Minimum Information for Publication of Quantitative Real-Time PCR Experiments guidelines recom-mend two or more *** impacts the credibility of these studies and causes dis-tortions in the gene expression *** tissue engineering,the accuracy of gene expression drives the best experimental or therapeutical *** cultivated DPsCs under two conditions:Undifferentiated and osteogenic dif-ferentiation,both for 35 *** evaluated the gene expression of 10 candidates for RGs[ribosomal protein,large,P0(RPLP0),TATA-binding protein(TBP),GAPDH,actin beta(ACTB),tubulin(TUB),aminolevulinic acid synthase 1(ALAs1),tyro-sine 3-monooxygenase/tryptophan 5-monooxygenase activation protein,zeta(YWHAZ),eukaryotic translational elongation factor 1 alpha(Ef1a),succinate dehydrogenase complex,subunit A,flavoprotein(sDHA),and beta-2-micro-globulin(B2M)]every 7 d(1,7,14,21,28,and 35 d)by *** data were analysed by the four main algorithms,ΔCt method,geNorm,Normfinder,and BestKeeper and ranked by the Reffinder *** subdivided the samples into eight *** All of the data sets from clonogenic and osteogenic samples were analysed using the Reffinder *** final ranking showed RPLP0/TBP as the two most stable RGs and TUB/B2M as the two least stable *** theΔCt method or Normfinder analysis showed TBP/RPLP0 as the two most stable ***,geNorm analysis showed RPLP0/Ef1αin the first *** algorithms’two least stab

关键词： Dental pulp stem cells Reference gene Housekeeping gene Endogenous gene Osteogenic differentiation Reffinder

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