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Rare earth-doped mixed Ni-Cu-Zn ferrites as an effective photocatalytic agent for active degradation of Rhodamine B dye

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Journal of Rare Earths 2024年第3期42卷 488-496,I0003页

作者： Swapnil A.Jadhav Sandeep B.Somvanshi Sudarshan S.Gawali kranti Zakde k.M.Jadhav Department of Physics Dr.Babasaheb Ambedkar Marathwada UniversityAurangabad431004MaharashtraIndia School of Materials Engineering Purdue UniversityWest Lafayette 47906USA University Department of Basic and Applied Sciences MGM UniversityAurangabad431003MaharashtraIndia

In this study, a series of Gd^(3+)-doped mixed Ni-Cu-Zn ferrites with composition of Zn_(0.5)Ni_(0.3)Cu_(0.2)Fe_(2-x)Gd_(x)O_(4)(x = 0, 0.025, 0.05, 0.075, 0.1) was prepared using self-ignition sol-gel method. The prepared nanoparticles with an average size ranging from 22 to 26 nm show a single-phase cubic structure belonging to the spinel matrix. A rise in the Gd^(3+)concentration leads to an increase in crystallite size and lattice parameter. In Fourier transform infrared spectra, two main absorption bands belonging to the spinel structure are observed. The high-frequency bands(v_(1)) represent the tetrahedral complex, while the lowfrequency bands(v_(2)) signify the octahedral complex. The optical bandgap of the nanoferrites is found within the range of 2.91 to 2.41 eV, depending on their size. The magnetic characteristics of the material,such as saturation magnetization and coercivity are significantly altered with the concentration of Gd^(3+)in the solution. Using Rhodamine B(RhB) as a model organic pollutant, an in-depth investigation of the photocatalytic activity of the compounds was carried out. The present outcomes show that adding an adequate amount of Gd^(3+)significantly enhances the number of hydroxyl radicals produced by the ferrite,in turn, increasing the photocatalytic activity of the material. Mechanism elucidated by scavenger studies reveals that ·OH and holes are the primary reactive radicals responsible for the degradation *** photocatalysts show an insignificant performance loss in five consecutive cycles. Thus, it is concluded that these photocatalysts are highly suitable for the remediation of dye-contaminated wastewater.

关键词： Gd^(3+)substitution Spinel ferrite Structural properties Magnetic properties Photocatalysis Rare earths

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Constructing on-demand single/multi-color transitioning fabrics with photocatalysis/photothermal-armed deficient semiconductors

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Nano Research 2024年第5期17卷 3633-3643页

作者： Daniel k.Macharia Shamima Sarker Meng Liu Zeyulong Wen Nuo Yu Meifang Zhu Zhigang Chen State key Laboratory for Modification of Chemical Fibers and Polymer Materials College of Materials Science and EngineeringDonghua UniversityShanghai 201620China

On-demand color switching systems that utilize synchronized semiconductor-catalyzed reduction and photothermal-accelerated oxidation in liquid/solid are highly ***,on-demand single/multi-color switching fabrics have been constructed by using defective SnO_(2):Sb-based color switching ***_(2):Sb nanocrystals with the suitable doping concentration accord lattices with abundant free electrons,conferring high photocatalytic and photothermal performances.A well-crafted set of dual light-responsive semiconductor-catalyzed systems with rapid color change can be attained via the homogenous mixture of SnO_(2):Sb with suitable redox dyes to produce single-color(RGB(red,green,blue))and multi-color transitioning(purple and green)*** illumination of these systems by 450 nm light triggers rapid photocatalytic discoloration,while irradiation by 980 nm light confers the photothermal effect that accelerates recoloration in ***,the inks can be extended to rewritable fabrics by embedding the nanocrystals and redox dyes into hydroxyethyl cellulose(as the polymer matrix)and then coating on hydrophobic cotton fabrics to produce photo-switchable fabrics with excellent single/multi-color *** exploiting the dual light interactions with the semiconductor-mediated systems,various images/letters can be remotely printed and erased on the rewritable fabrics which show promise for potential applications as information storage media and visual ***,the present rewritable fabric shows good stability and *** present work provides insights into the development of novel color-switching materials.

关键词： color switching defective semiconductor photocatalysis photothermal rewritable fabrics

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Sparse identification-assisted exploration of the atomic-scale deformation mechanism in multiphase CoCrFeNi high-entropy alloys

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Science China(Technological Sciences) 2024年第4期67卷 1124-1132页

作者： XIAO Lu GUO XiaoXiang SUN YuTong WANG Gang LONG WeiMin LIAW Peter k. REN JingLi School of Mathematics and Statistics Zhengzhou UniversityZhengzhou 450001China Academy of Mathematics and Systems Science Chinese Academy of SciencesBeijing 100190China Institute of Materials Shanghai UniversityShanghai 200444China SkL of Advanced Brazing Metals&Technology Zhengzhou Research Institute of Mechanical EngineeringZhengzhou 450001China Department of Materials Science and Engineering The University of TennesseeKnoxvilleTN 37996USA

This study investigated the atomic-scale deformation mechanism of multiphase CoCrFeNi high-entropy alloys(HEAs)at liquid helium,liquid nitrogen,and room temperatures.A million-atom multiphase HEA was prepared using molecular dynamics simulation involving melt and quench *** HEA exhibited high-density dislocations and some twins,consistent with experimental *** analysis revealed an inconsistent evolution of the microstructure under tensile *** particular,the elastic and initial plastic stages exhibited an increase in the disordered structure at the expense of the face-centered cubic and hexagonal close-packed structures,followed by a subsequent transformation involving multiple structural ***,through sparse identification,a model depicting microstructural evolution during tension was extracted for the CoCrFeNi HEA at three typical temperatures and three tensile *** model highlighted the importance of the body-centered cubic structure in the evolutionary process.

关键词： high-entropy alloy data-driven method microstructure evolution multiphase structure molecular dynamics simulation

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Understanding Bonding Nature ofα-keggin Polyoxometalates[XW_(12)O_(40)]^(n−)(X=Al,Si,P,S):A Generalized Superatomic Perspective

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Energy & Environmental Materials 2024年第6期7卷 176-183页

作者： Rui Li Yulei Shi Famin Yu Rui Wang Haitao Yan Boon k.Teo Zhigang Wang Department of Physics Capital Normal UniversityBeijing 100048China key Laboratory of Material Simulation Methods&Software of Ministry of Education College of PhysicsJilin UniversityChangchun 130012China Institute of Atomic and Molecular Physics Jilin UniversityChangchun 130012China State key Laboratory for Physical Chemistry of Solid Surfaces College of Chemistry and Chemical EngineeringXiamen UniversityXiamen 361005China Institute of Theoretical Chemistry College of ChemistryJilin UniversityChangchun 130012China

α-keggin polyoxometalates(POMs)[XW_(12)O_(40)]^(n−)(X=Al,Si,P,S)are widely used in batteries owing to their remarkable redox ***,the mechanism underlying the applications appears inconsistent with the widely accepted covalent bonding ***,first-principles calculations show that XW_(12)are core–shell structures composed of a shell and an XO_(4)^(n−)core,both are stabilized by covalent ***,owing to the presence of a substantial number of electrons in W_(12)O_(36)shell,the frontier molecular orbitals of XW_(12)are not only strongly delocalized but also exhibit superatomic properties with high-angular momentum electrons that do not conform to the Jellium *** analysis indicates that energetically high lying filled molecular orbitals(MOs)have reached unusually high-angular momentum characterized by quantum number k or higher,allowing for the accommodation of numerous *** attribute confers strong electron acceptor ability and redox activity to XW_(12).Moreover,electrons added to XW_(12)still occupy the k orbitals and will not cause rearrangement of the MOs,thereby maintaining the stability of these *** findings highlight the structure–activity relationship and provide a direction for tailor-made POMs with specific properties at atomic level.

关键词： first principles molecular orbital polyoxometalate redox activity superatom

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Acceptor doping and actuation mechanisms in Sr-doped BiFeO_(3)-BaTiO_(3)ceramics

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Journal of Materiomics 2024年第1期10卷 57-69页

作者： Ziqi Yang Yizhe Li Bing Wang Juncheng Pan Annette k.kleppe David A.Hall Department of Materials University of ManchesterM139PLManchesterUK Diamond Light Source Ltd. Harwell Science and Innovation CampusOX110DEDidcotUK

BiFeO_(3)-BaTiO_(3)(BF-BT)ceramics are important multiferroic materials,which are attracting significant attention for potential applications in high temperature lead-free piezoelectric *** the present study,the effects of Sr^(2+)as an acceptor dopant for Bi^(3+),in the range from 0 to 1.0%(in mole),on the structure and ferroelectric/piezoelectric properties of 0.7BiFeO_(3)-0.3BaTiO_(3)ceramics were *** use of a post-sintering Ar annealing process was found to be an effective approach to reduce electrical conductivity induced by the presence of electron holes associated with reoxidation during cooling.A low Sr dopant concentration(0.3%,in mole)yielded enhanced ferroelectric(P_(max)∼0.37 C/m^(2),P_(r)∼0.30 C/m^(2))and piezoelectric(d_(33)∼178 pC/N,k_(p)∼0.27)properties,whereas higher levels led to chemically heterogeneous core-shell structures and secondary phases with an associated decline in *** electric field-induced strain of the Sr-doped BF-BT ceramics was investigated using a combination of digital image correlation macroscopic strain measurements and in-situ synchrotron X-ray *** of the intrinsic(lattice strain)and extrinsic(domain switching)contributions to the electric field induced strain indicated that the intrinsic contribution dominated during the poling process.

关键词： Bismuth ferrite-barium titanate Acceptor doping Electroceramics Piezoelectricity In-situ X-ray diffraction

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Experimental study on the effect of micro-carbon additives in vegetable oils for aquifer thermal energy storage

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Clean Energy 2024年第2期8卷 48-59页

作者： Takashi Suzuki Mitsuhisa Ichiyanagi Emir Yilmaz Archie G.k.Maxwell Ekadewi Anggraini Handoyo Department of Engineering and Applied Sciences Sophia University7-1Kioi-choChiyoda-kuTokyo102-8554Japan Graduate School of Science and Technology Sophia University7-1Kioi-choChiyoda-kuTokyo102-8554Japan Department of Mechanical Engineering Petra Christian UniversitySiwalankerto 121-131Surabaya 60291Indonesia

Aquifer thermal energy storage is a versatile method for regulating building temperatures,utilizing groundwater as a medium for both summer cooling and winter *** has high thermal conductivity and specific heat but is corrosive,creating a mineral build-up that causes ***,its high freezing point presents operational *** oils emerge as a promising alternative,owing to their lower freezing *** light of environmental concerns,researchers are exploring vegetable oils as substitutes for petroleum-derived mineral *** paper is intended as an initial study using vegetable oils,*** and sunflower oil,as the heat-transfer medium in aquifer thermal energy *** experiments assess the heat-transfer coefficient of coconut,sunflower,mineral,and synthetic oils when exposed to the same heat *** study also evaluates the impact of introducing micro-carbon(graphite and charcoal)to the *** indicate that sunflower oil has the highest heat-transfer coefficient of 374.4 W/m^(2) k among the oils,making it suitable for aquifer thermal energy storage ***,augmenting sunflower oil with charcoal powder enhances its performance by increasing the heat-transfer coefficient to 474.9 W/m^(2) k,or a 27%*** contrast,coconut oil proves unsuitable for aquifer thermal energy storage deployment because of its low heat-transfer coefficient of 293.7 W/m^(2) *** heat-transfer coefficient of synthetic oil increases with graphite powder but decreases with charcoal powder introduction.

关键词： sunflower oil aquifer thermal energy storage charcoal graphite vegetable oil

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Role of flexible sensors for the electrochemical detection of organophosphate-based chemical warfare agents

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International Journal of Smart and Nano Materials 2024年第3期15卷 502-533页

作者： Aman Dubey Aamir Ahmed Rakesh Singh Anoop Singh Ashok k.Sundramoorthy Sandeep Arya Department of Physics University of JammuJammuJammu and KashmirIndia Department of Humanities and Sciences Guru Nanak Institutions Technical CampusHyderabadIndia Centre for Global Health Research Saveetha Medical College and HospitalsSaveetha Institute of Medical and Technical SciencesChennaiTamil NaduIndia Department of Prosthodontics Saveetha Dental College and HospitalsSaveetha Institute of Medical and Technical SciencesChennaiTamil NaduIndia

This review article comprehensively explores the electrochemi-cal detection of organophosphate-based agents,including war-fare agents,pesticides,and *** provides an in-depth analysis of their molecular structures,emphasizing the inherent toxicity and environmental risks posed by these *** review highlights the significant role of flexible sensors in facilitating the electrochemical detection of organophosphate-based agents,offering insights into their design,development,and application in detection ***,the article critically evaluates the challenges encountered in this field,such as sensor sensitivity and sample complexity,and discusses potential solutions to address these ***,it outlines the future scope and opportunities for advancement in electrochemical detection technologies,includ-ing the integration of novel materials and the exploration of innovative detection *** synthesizing current research findings and identifying future research directions,this review contributes to the ongoing discourse on the detection and mitigation of organophosphate-based agents’risks to human health and the environment.

关键词： Chemical warfare agents electrochemical detection flexible nanosensors organophosphates pesticides

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Smart Healthcare Activity Recognition Using Statistical Regression and Intelligent Learning

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Computers, Materials & Continua 2024年第1期78卷 1189-1205页

作者： k.Akilandeswari Nithya Rekha Sivakumar Hend khalid Alkahtani Shakila Basheer Sara Abdelwahab Ghorashi Department of Computer Sciences Government Arts College(Autonomous)Salem636007India Department of Computer Sciences College of Computer and Information SciencesPrincess Nourah Bint Abdulrahman UniversityRiyadh11671Saudi Arabia Department of Information Systems College of Computer and Information SciencesPrincess Nourah Bint Abdulrahman UniversityRiyadh11671Saudi Arabia

In this present time,Human Activity Recognition(HAR)has been of considerable aid in the case of health monitoring and *** exploitation of machine learning with an intelligent agent in the area of health informatics gathered using HAR augments the decision-making quality and *** many research works conducted on Smart Healthcare Monitoring,there remain a certain number of pitfalls such as time,overhead,and falsification involved during ***,this paper proposes a Statistical Partial Regression and Support Vector Intelligent Agent Learning(SPR-SVIAL)for Smart Healthcare *** first,the Statistical Partial Regression Feature Extraction model is used for data preprocessing along with the dimensionality-reduced features extraction ***,the input dataset the continuous beat-to-beat heart data,triaxial accelerometer data,and psychological characteristics were acquired from IoT wearable *** attain highly accurate Smart Healthcare Monitoring with less time,Partial Least Square helps extract the dimensionality-reduced *** that,with these resulting features,SVIAL is proposed for Smart Healthcare Monitoring with the help of Machine Learning and Intelligent Agents to minimize both analysis falsification and *** evaluation is carried out for factors such as time,overhead,and false positive rate accuracy concerning several *** quantitatively analyzed results indicate the better performance of our proposed SPR-SVIAL method when compared with two state-of-the-art methods.

关键词： Internet of Things smart health care monitoring human activity recognition intelligent agent learning statistical partial regression support vector

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Geochemistry and depositional environment of fuchsite quartzites from Sargur Group,western Dharwar Craton,India

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Acta Geochimica 2024年第3期43卷 555-570页

作者： C.S.Sindhuja G.Harshitha C.Manikyamba k.S.V.Subramanyam CSIR(Council of Scientific and Industrial Research)-National Geophysical Research Institute(NGRI) Uppal RoadHyderabad 500007India

Meso-Neoarchean fuchsite quartzites are present in different stratigraphic positions of Dharwar Craton including the oldest(~3.3 Ga)Sargur Group of western Dharwar *** present study deals with the petro-graphic and geochemical characteristics of the fuchsite quartzites from the Ghattihosahalli belt to evaluate their genesis,depositional setting and the enigma involved in the ancient sedimentation *** major mineral assemblages include quartz,fuchsite,and feldspars along with accessory kyanite and *** geochemical com-positions are characterized by high SiO_(2),Al_(2)O_(3),low MgO,CaO,strongly enriched Cr(1326–6899 ppm),Ba(1165–3653 ppm),Sr(46–210 ppm),V(107–868 ppm)and Zn(11–158 ppm)contents compared to the upper continental crust(UCC).The UCC normalized rare earth element(REE)patterns are characterized by depleted light REE[(La/Sm)UCC=0.33–0.95]compared to heavy REE[(Gd/Yb)_(UCC)=0.42–1.65]with conspicuous positive Eu-anomalies(Eu/Eu^(*)=1.35–18.27)characteristic of hydrothermal solutions evidenced through the interlayered *** overall major and trace element systematics reflect a combined mafic-felsic provenance and suggest their deposition at a passive continental margin *** comprehensivefield,petrographic,and geo-chemical studies indicate that these quartzites are infiltrated by Cr-richfluids released during high-grade metamorphism of associated ultramafic *** Sargur and the subse-quent Dharwar orogeny amalgamated diverse lithounits from different tectonic settings,possibly leading to the release of Cr-richfluids and the formation of fuchsite quartzite during or after the *** sug-gest a pre-existing stable crust prior to the Sargur Group and the link between orogenic events and various mineral deposits in the Dharwar Craton.

关键词： Dharwar Craton Ghattihosahalli Fuchsite quartzite Provenance Depositional setting

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Prioritizing Indicators for Rapid Response in Global Health Security: A Bayesian Network Approach

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INTERNATIONAL JOURNAL OF DISASTER RISk SCIENCE 2024年第4期15卷 536-551页

作者： Qazi, Abroon Simsekler, Mecit Can Emre Al-Mhdawi, M. k. S. Amer Univ Sharjah Sch Business Adm Sharjah 26666 U Arab Emirates khalifa Univ Sci & Technol Dept Management Sci & Engn Abu Dhabi 127788 U Arab Emirates Teesside Univ Sch Comp Engn & Digital Technol Middlesbrough TS1 3BX England

This study explored a Bayesian belief networks (BBNs) approach, developing two distinct models for prioritizing the seven indicators related to the "rapid response to and mitigation of the spread of an epidemic" category within the context of both the specific category and the Global Health Security Index (GHS index). Utilizing data from the 2021 GHS index, the methodology involves rigorous preprocessing, the application of the augmented naive Bayes algorithm for structural learning, and k-fold cross-validation. key findings show unique perspectives in both BBN models. In the mutual value of information analysis, "linking public health and security authorities" emerged as the key predictor for the "rapid response to and mitigation of the spread of an epidemic" category, while "emergency preparedness and response planning" assumed precedence for the GHS index. Sensitivity analysis highlighted the critical role of "emergency preparedness and response planning" and "linking public health and security authorities" in extreme performance states, with "access to communications infrastructure" and "trade and travel restrictions" exhibiting varied significance. The BBN models exhibit high predictive accuracy, achieving 83.3% and 82.3% accuracy for extreme states in "rapid response to and mitigation of the spread of an epidemic" and the GHS index, respectively. This study contributes to the literature on GHS by modeling the dependencies among various indicators of the rapid response dimension of the GHS index and highlighting their relative importance based on the mutual value of information and sensitivity analyses.

关键词： Bayesian belief networks Global health security Indicators Mitigation Policy implications Rapid response RISk DISEASE

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