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Engineering of efficient visible light photocatalysts:Ti_(1-x+y)Cu_(x)La_(y)O_(2)(x=0.03;y=0,0.005,0.01) compositions

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Journal of Rare Earths 2024年第3期42卷 497-505,I0003页

作者： s.M.Yakout A.M.Youssef Inorganic Chemistry Department National Research Centre(NRC)El Buhouth StDokkiCairo12622Egypt

In dye-photocatalysis, widening the wavelengths absorption range of catalysts as well as aborting the recombination of the photoexcited charge carriers(electrons-holes pairs) are of paramount *** the current study, we report the photocatalytic characteristics of four compositions composed of TiO_(2),Ti_(0.97)Cu_(0.03)O_(2), Ti_(0.965)Cu_(0.03)La_(0.005)O_(2)and Ti_(0.96)Cu_(0.03)La_(0.01)O_(2)powders for two harmful dyes(Congo red and methylene blue). The X-ray diffraction technique verified the configuration of mixed anatase and rutile phases in pure TiO_(2)and Ti_(0.97)Cu_(0.03)O_(2)powders while Ti_(0.965)Cu_(0.03)La_(0.005)O_(2)and Ti_(0.96)Cu_(0.03)La_(0.01)O_(2)powders possess anatase phase only. The changes of the band gap structure and dimensions of the unit cell volume of TiO_(2)confirm the substitution of Ti^(4+)sites by Cu^(2+)and La^(3+)ions. Remarkable widening of wavelengths absorption with formation of long absorption tails were found in TiO_(2)(3.13 e V) through insertion of La^(3+)plus Cu^(2+)ions. Ti_(0.965)Cu_(0.03)La_(0.005)O_(2)and Ti_(0.96)Cu_(0.03)La_(0.01)O_(2)samples exhibit a visible light band gap of 2.3 and 2.7 e V, respectively. Based on sEM images, incorporation of Cu^(2+)and La^(3+)ions influences the surface morphology of TiO_(2). The resulting Ti_(0.97)Cu_(0.03)O_(2), Ti_(0.965)Cu_(0.03)La_(0.005)O_(2)and Ti_(0.96)Cu_(0.03)La_(0.01)O_(2)powders present enhanced photocatalytic activity towards Congo red dye degradation compared to pure one under natural solar spectrum. The best Ti_(0.96)Cu_(0.03)La_(0.01)O_(2)catalyst exhibits superior photocatalytic activity of 96% for 10 ppm CR dye in 20 min as well as above average photocatalytic efficiency of 63% for 30 ppm CR dye in 120 min. As well, it showed acceptable photodegradation activity of 52% for 30 ppm MB solution in 140 min of sunlight irradiation. The heightened photodegradation efficiency of Ti_(0.96)Cu_(0.03)La_(0.01)O_(2)catalyst can be clarified in terms of higher ch

关键词： semiconductor TiO_(2) Rare earths Congo red Methylene blue solar spectrum Photodegradation

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Enhanced entropy generation and heat transfer characteristics of magnetic nano-encapsulated phase change materials in latent heat thermal energy storage systems

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Applied Mathematics and Mechanics(English Edition) 2024年第6期45卷 1051-1070页

作者： P.s.REDDY P.sREEDEVI Department of Mathematics Rajeev Gandhi Memorial College of Engineering and TechnologyNandyal 518501India

The objective of the current study is to investigate the importance of entropy generation and thermal radiation on the patterns of velocity,isentropic lines,and temperature contours within a thermal energy storage device filled with magnetic nanoencapsulated phase change materials(NEPCMs).The versatile finite element method(FEM)is implemented to numerically solve the governing *** effects of various parameters,including the viscosity parameter,ranging from 1 to 3,the thermal conductivity parameter,ranging from 1 to 3,the Rayleigh parameter,ranging from 102 to 3×10^(2),the radiation number,ranging from 0.1 to 0.5,the fusion temperature,ranging from 1.0 to 1.2,the volume fraction of NEPCMs,ranging from 2%to 6%,the stefan number,ranging from 1 to 5,the magnetic number,ranging from 0.1 to 0.5,and the irreversibility parameter,ranging from 0.1 to 0.5,are examined in detail on the temperature contours,isentropic lines,heat capacity ratio,and velocity ***,the heat transfer rates at both the cold and hot walls are analyzed,and the findings are presented *** results indicate that the time taken by the NEPCMs to transition from solid to liquid is prolonged inside the chamber region as the fusion temperatureθf ***,the contours of the heat capacity ratio Cr decrease with the increase in the stefan number ste.

关键词： volume fraction of nano-encapsulated phase change material(NEPCM) radiation stefan number heat capacity ratio entropy generation

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In situ nanoscale mapping of electrical and catalytic properties

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National science Review 2024年第7期11卷 65-66页

作者： Christopher s.Kley Helmholtz Young Investigator Group Nanoscale Operando CO2 Photo-Electrocatalysis Helmholtz-Zentrum Berlin für Materialien und Energie GmbH Department of Interface science Fritz Haber Institute of the Max Planck Society

By enabling the conversion of sustainably-derived electrical energy into chemical energy, electrocatalytic reactions are vital for closing the anthropogenic carbon cycle. A wide array of electrocatalytic reactions have gained extensive attention, including hydrogen evolution（HER）, oxygen evolution（OER）, and CO2electroreduction（CO2RR）.

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Mathematical modeling and simulations of stress mitigation by coating polycrystalline particles in lithium-ion batteries

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Applied Mathematics and Mechanics(English Edition) 2024年第6期45卷 947-962页

作者： N.IQBAL J.CHOI s.F.sHAH C.LEE s.LEE Department of Mechanical Roboticsand Energy EngineeringDongguk University-SeoulSeoul 04620Republic of Korea

A chemo-mechanical model is developed to investigate the effects on the stress development of the coating of polycrystalline Ni-rich LiNixMnyCo_(z)O_(2)(x≥0.8)(NMC)particles with poly(3,4-ethylenedioxythiophene)(PEDOT).The simulation results show that the coating of primary NMC particles significantly reduces the stress generation by efficiently accommodating the volume change associated with the lithium diffusion,and the coating layer plays roles both as a cushion against the volume change and a channel for the lithium transport,promoting the lithium distribution across the secondary particles more ***,the lower stiffness,higher ionic conductivity,and larger thickness of the coating layer improve the stress *** paper provides a mathematical framework for calculating the chemo-mechanical responses of anisotropic electrode materials and fundamental insights into how the coating of NMC active particles mitigates stress levels.

关键词： lithium-ion battery(LIB) polycrystalline particle coating finite element simulation Ni-rich LiNixMnyCo_(z)O_(2)(x>0.8)(NMC)

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A new route to weak force sensing beyond sQL:squeezed magnons in cavity magnomechanics

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science China(Physics,Mechanics & Astronomy) 2024年第10期67卷 166-167页

作者： s.K.Özdemir Department of Engineering science and Mechanics and Materials Research Institute(MRI)The Pennsylvania State UniversityUniversity ParkPA 16802USA

Quantum mechanics imposes limits on measurement accuracy through quantum noise which typically has two components:First is the shot noise originating from vacuum fluctuations and referred to as the imprecision *** is ... 详细信息

关键词： quantum typically vacuum

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High-precision inverse potentials for neutron-proton scattering using piece-wise smooth Morse functions

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Chinese Physics C 2024年第10期48卷 201-213页

作者： Ayushi Awasthi Arushi sharma Ishwar Kant O.s.K.s.sastri Department of Physics and Astronomical science Central University of Himachal PradeshDharmshala176215India

The aim of this study is to construct inverse potentials for various ℓ-channels of neutron-proton scattering using a piece-wise smooth Morse function as a *** phase equations for single-channel states and the coupled equations of multi-channel scattering are solved numerically using the 5^(th) order Runge-kutta *** employ a piece-wise smooth reference potential comprising three Morse functions as the initial *** a machine learning-based genetic algorithm,we optimize the model parameters to minimize the mean-squared error between simulated and anticipated phase *** approach yields inverse potentials for both single and multichannel scattering,achieving convergence to a mean-squared error≤10^(-3).The resulting scattering lengths"a_(0)"and effective ranges"r"for ^(3)s_(1) and ^(1)s_(0) states,expressed as[a_(0),r],are found to be[5.445(5.424),1.770(1.760)]and[–23.741(–23.749),2.63(2.81)],respectively;these values are in excellent agreement with experimental ***,the calculated total scattering cross-sections are highly consistent with their experimental counterparts,having a percentage error of less than 1%.This computational approach can be easily extended to obtain interaction potentials for charged particle scattering.

关键词： inverse potentials neutron-proton scattering piece-wise smooth Morse function phase function method reference potential approach genetic algorithm

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Changes in properties of tar obtained during underground coal gasification process

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International Journal of Coal science & Technology 2021年第5期8卷 1054-1066页

作者： Marian Wiatowski Roksana Muzyka Krzysztof Kapusta Maciej chrubasik Central Mining Institute Plac Gwarków 140-166 KatowicePoland Institute for Chemical Processing of Coal 1 Zamkowa St41-803 ZabrzePoland

In this study,the composition of tars collected during a six-day underground coal gasification(UCG)test at the experimental mine‘Barbara’in Poland in 2013 was *** the test,tar samples were taken every day from the liquid product separator and analysed by the methods used for testing properties of typical coke oven(coal)*** obtained results were compared with each other and with the data for coal *** gasification progressed,a decreasing trend in the water content and an increasing trend in the ash content were *** tars tested were characterized by large changes in the residue after coking and content of parts insoluble in toluene and by smaller fluctuations in the content of parts insoluble in *** tested samples were characterized by very high distillation losses,while for samples starting from the third day of gasification,a clear decrease in losses was visible.A chromatographic analysis showed that there were no major differences in composition between the tested tars and that none of the tar had a dominant component such as naphthalene in coal *** content of polycyclic aromatic hydrocarbons(PAHs)in UCG tars is several times lower than that in coal *** light monoaromatic hydrocarbons(benzene,toluene,ethylbenzene and xylenes—BTEX)were found in the analysed tars,which results from the fact that these compounds,due to their high volatility,did not separate from the process gas in the liquid product separator.

关键词： Underground coal gasification UCG Pilot trial Tar BTEX PAHs Phenols

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Quantized autoencoder(QAE)intrusion detection system for anomaly detection in resource-constrained loT devices using RT-loT2022 dataset

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Cybersecurity 2024年第2期7卷 13-27页

作者： B s sharmila Rohini Nagapadma Depatment of Electronics and Communication Engineering The National Institute of EngineeringMysoreKarnataka 570008India

In recent years,many researchers focused on unsupervised learning for network anomaly detection in edge devices to identify *** deployment of the unsupervised autoencoder model is computationally expensive in resource-constrained edge *** study proposes quantized autoencoder(QAE)model for intrusion detection systems to detect *** is an optimization model derived from autoencoders that incorporate pruning,clustering,and integer quantization *** autoencoder uint8(QAE-u8)and quantized autoencoder float16(QAE-f16)are two variants of QAE built to deploy computationally expensive Al models into Edge ***,we have generated a Real-Time Internet of Things 2022 dataset for normal and attack *** autoencoder model operates on normal traffic during the training *** same model is then used to reconstruct anomaly traffic under the assumption that the reconstruction error(RE)of the anomaly will be high,which helps to identify the ***,we study the performance of the autoencoders,QAE-u8,and QAE-f16 using accuracy,precision,recall,and F1 score through an extensive experimental *** showed that QAE-u8 outperforms all other models with a reduction of 70.01%in average memory utilization,92.23%in memory size compression,and 27.94%in peak CPU ***,the proposed QAE-u8 model is more suitable for deployment on resource-constrained IoT edge devices.

关键词： IoT constrained system

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A study on the Explainability of Thyroid Cancer Prediction:sHAP Values and Association-Rule Based Feature Integration Framework

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Computers, Materials & Continua 2024年第5期79卷 3111-3138页

作者： sujithra sankar s.sathyalakshmi Department of Computer Applications Hindustan Institute of Technology and ScienceChennaiTamil NaduIndia Department of Computer Engineering Hindustan Institute of Technology and ScienceChennaiTamil NaduIndia

In the era of advanced machine learning techniques,the development of accurate predictive models for complex medical conditions,such as thyroid cancer,has shown remarkable *** predictivemodels for thyroid cancer enhance early detection,improve resource allocation,and reduce ***,the widespread adoption of these models in clinical practice demands predictive performance along with interpretability and *** paper proposes a novel association-rule based feature-integratedmachine learning model which shows better classification and prediction accuracy than present *** study also focuses on the application of sHapley Additive exPlanations(sHAP)values as a powerful tool for explaining thyroid cancer prediction *** the proposed method,the association-rule based feature integration framework identifies frequently occurring attribute combinations in the *** original dataset is used in trainingmachine learning models,and further used in generating sHAP values *** the next phase,the dataset is integrated with the dominant feature sets identified through association-rule based *** new integrated dataset is used in re-training the machine learning *** new sHAP values generated from these models help in validating the contributions of feature sets in predicting *** conventional machine learning models lack interpretability,which can hinder their integration into clinical decision-making *** this study,the sHAP values are introduced along with association-rule based feature integration as a comprehensive framework for understanding the contributions of feature sets inmodelling the *** study discusses the importance of reliable predictive models for early diagnosis of thyroid cancer,and a validation framework of *** proposed model shows an accuracy of 93.48%.Performance metrics such as precision,recall,F1-score,and the area un

关键词： Explainable AI machine learning clinical decision support systems thyroid cancer association-rule based framework sHAP values classification and prediction

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Correlation Composition Awareness Model with Pair Collaborative Localization for IoT Authentication and Localization

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Computers, Materials & Continua 2024年第4期79卷 943-961页

作者： Kranthi Alluri s.Gopikrishnan school of Computer science and Engineering VIT-AP UniversityAmaravathiAndhra Pradesh522241India

secure authentication and accurate localization among Internet of Things(IoT)sensors are pivotal for the functionality and integrity of IoT *** authentication and localization are intricate and symbiotic,impacting both the security and operational functionality of IoT ***,accurate localization and lightweight authentication on resource-constrained IoT devices pose several *** overcome these challenges,recent approaches have used encryption techniques with well-known key ***,these methods are inefficient due to the increasing number of data breaches in their localization *** proposed research efficiently integrates authentication and localization processes in such a way that they complement each other without compromising on security or *** proposed framework aims to detect active attacks within IoT networks,precisely localize malicious IoT devices participating in these attacks,and establish dynamic implicit authentication *** integrated framework proposes a Correlation Composition Awareness(CCA)model,which explores innovative approaches to device correlations,enhancing the accuracy of attack detection and ***,this framework introduces the Pair Collaborative Localization(PCL)technique,facilitating precise identification of the exact locations of malicious IoT *** address device authentication,a Behavior and Performance Measurement(BPM)scheme is developed,ensuring that only trusted devices gain access to the *** work has been evaluated across various environments and compared against existing *** results prove that the proposed methodology attains 96%attack detection accuracy,84%localization accuracy,and 98%device authentication accuracy.

关键词： sensor localization IoT authentication network security data accuracy precise location access control security framework

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