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Ferroelectricity Induced by Oxygen Vacancies in Rhombohedral ZrO_(2) Thin Films

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Energy & Environmental materials 2024年第1期7卷 229-237页

作者： Veniero Lenzi José P.B.silva Břetislav Šmíd Vladimir matoín Cosmin m.Istrate Corneliu Ghica Judith L.macmanus-Driscoll Luís marques Physics Center of minho and Porto Universities(CF-Um-UP) University of MinhoCampus de Gualtar 4710-057Braga Portugal Laboratory of Physics for materials and Emergent Technologies LapMETUniversity of Minho4710-057Braga Portugal Department of surface and Plasma science Faculty of Mathematics and PhysicsCharles UniversityV Holešovičkách 218000Prague 8 Czech Republic National Institute of materials Physics 105 bis Atomistilor 077125Magurele Romania Department of materials science and metallurgy 27 Charles Babbage Rd.Cambridge CB3 OFSUK

Rhombohedral phase Hf_(x)Zr_(1.x)O_(2)(HZO,x from 0 to 1)films are promising for achieving robust ferroelectric polarization without the need for an initial wake-up pre-cycling,as is normally the case for the more commonly studied orthorhombic ***,a large spontaneous polarization observed in rhombohedral films is not fully understood,and there are also large discrepancies between experimental and theoretical *** this work,in rhombohedral ZrO_(2)thin films,we show that oxygen vacancies are not only a key factor for stabilizing the phase,but they are also a source of ferroelectric polarization in the *** is shown experimentally through the investigation of the structural properties,chemical composition and the ferroelectric properties of the films before and after an annealing at moderate temperature(400℃)in an oxygen environment to reduce the V_(o)concentration *** experimental work is supported by density functional theory(DFT)calculations which show that the rhombohedral phase is the most stable one in highly oxygen defective ZrO_(2)*** DFT calculations also show that V_(o)contribute to the ferroelectric *** findings reveal the importance of V_(o)for stabilizing rhombohedral ZrO_(2)thin films with superior ferroelectric properties.

关键词： charged defects ferroelectric polarization rhombohedral phase stability zirconia

Planetary Homeostasis of Reactive Nitrogen Through Anaerobic Ammonium Oxidation

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Engineering 2024年第7期38卷 175-183页

作者： Guibing Zhu Bangrui Lan shuci Liu Cameron m.Callbeck shanyun Wang Liping Jiang Asheesh Kumar Yadav Jan Vymazal mike s.m.Jetten Ganlin Zhang Yongguan Zhu Research Center for Eco-Environmental sciences Chinese Academy of SciencesBeijing 100085China Department of Environment and science Queensland GovernmentBrisbaneQLD 4102Australia Department of Environmental sciences University of BaselBasel 4056Switzerland CsIR-Institute of minerals and materials Technology Bhubaneswar 751013India Faculty of Environmental sciences Czech University of Life Sciences PraguePraha 16521Czech Republic Department of microbiology Radboud UniversityNijmegen 6525 XZThe Netherlands Key Laboratory of Watershed Geographic sciences Nanjing Institute of Geography and LimnologyChinese Academy of SciencesNanjing 210008China state Key Laboratory of soil and sustainable Agriculture Institute of Soil ScienceChinese Academy of SciencesNanjing 210008China University of Chinese Academy of sciences Beijing 100049China

The availability of nitrogen(N)is crucial for both the productivity of terrestrial and aquatic ecosystems ***,the overuse of artificial fertilizers and the energy required to fix nitrogen have pushed the global nitrogen cycle(N-cycle)past its safe operating limits,leading to severe nitrogen pollution and the production of significant amounts of greenhouse gas nitrous oxide(N2O).The anaerobic ammonium oxidation(anammox)mechanism can counteract the release of ammonium and N2O in many oxygenlimited situations,assisting in the restoration of the homeostasis of the Earth’s N *** this work,we looked into the characteristics of the anammox hotspots’distribution across various types of ecosystems *** hotspots are present at diverse oxic-anoxic interfaces in terrestrial systems,and they are most prevalent at the oxic-anoxic transition zone in aquatic *** on the discovery of an anammox hotspot capable of oxidizing ammonium anoxically into N2 without N2O by-product,we then designed an innovative concept and technical routes of nature-based anammox hotspot geoengineering for climate change,biodiversity loss,and efficient utilization of water *** 15 years of actual use,anammox hotspot geoengineering has proven to be effective in ensuring clean drinking water,regulating the climate,fostering plant and animal diversity,and enhancing longterm environmental *** sustainable biogeoengineering of anammox could be a workable natural remedy to resolve the conflicts between environmental pollution and food security connected to N management.

关键词： Biogeochemical N-cycle Oxic-anoxic interface Nature-based solution Biogeoengineering Nitrogen sustainable development

Rare earth based mgPm_(2)X_(4)(X=s,se) spinel chalcogenides for spintronic and thermoelectric applications

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Journal of Rare Earths 2024年第8期42卷 1577-1585,I0006页

作者： Tariq m.Al-Daraghmeh Omar Zayed Ghulam m.mustafa Taharh Zelai Bisma Younas Hind Albalawi s.Bouzgarrou Othman Hakami Q.mahmood Khaild I.Hussein Basic sciences Department King Abdullah Ⅱ School of EngineeringPrincess Sumaya University For TechnologyP.O.Box 1438Al-jubaiha11941AmmanJordan Department of Physics Division of Science&TechnologyUniversity of EducationLahorePakistan Department of Physics Faculty of ScienceJazan University JazanSaudi Arabia Department of Physics The University of LahoreLahorePakistan Department of Physics College of SciencesPrincess Nourah bint Abdulrahman University(PNU)P.O.Box 84428Riyadh11671Saudi Arabia Department of Physics College of ScienceQassim UniversityPo.64BuraidahSaudi Arabia Laboratoire de microelectronique et Instrumentation(UR 03/13-04) Faculte des Sciences de MonastirAvenue de I'Environnement 5000MonastirTunisia Department of Chemistry Faculty of ScienceJazan University JazanSaudi Arabia Basic&Applied scientific Research Center Department of PhysicsCollege of ScienceImam Abdulrahman Bin Faisal UniversityP.O.Box 1982Dammam 31441Saudi Arabia Department of Radiological sciences College of Applied Medical SciencesKing Khalid UniversityAbha61421Saudi Arabia

In current report,the structural,magnetic,and thermoelectric properties of RE doped mgPm_(2)X_(4)(X=s,se) spinels were *** energy difference in ferromagnetic and antiferromagnetic states reveals the stability of mgPm_(2)(s/se)_(4) in the ferromagnetic *** co mputation of enthalpy of formation also ascertains thermodynamic stability of crystal ***-dependent band structure and density of states analysis reveal ferromagnetic semiconducting character showing different electronic behavior in both spin *** room temperature ferromagnetism,spin polarization and Curie temperature are estimated from exchange energies *** addition,exchange constants(N_(0)α and N_(0)β),exchange energy Δ_(x)(pd),crystal ifeld energy,and double exchange mechanism were studied to explore the magnetic ***,the electrical conductivity,thermal conductivity,seebeck co-efficient,and power factor show effect on electrons spin and their potential for thermoelectric devices.

关键词： Rare earth elements spintronic applications Thermoelectric effects Exchange energies

Laser processing effects on Ti−45Nb alloy surface,corrosive and biocompatible properties

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Transactions of Nonferrous metals society of China 2024年第8期34卷 2533-2551页

作者： I.CVIJOVIĆ-ALAGIĆ s.LAKETIĆ m.mOmČILOVIĆ J.CIGANOVIĆ Đ.VELJOVIĆ J.BAJAT V.KOJIĆ m.RAKIN Vinča Institute of Nuclear sciences-National Institute of thеRepublic of serbia University of BelgradeP.O.Box 52211001 BelgradeSerbia Faculty of Technology and metallurgy University of BelgradeKarnegijeva 411120 BelgradeSerbia Oncology Institute of Vojvodina Faculty of MedicineUniversity of Novi SadPut Dr Goldmana 421204 Sremska KamenicaSerbia

The Ti−45Nb(wt.%)alloy properties were investigated in relation to its potential biomedical *** surface modification was utilized to improve its performance in biological *** a result of the laser treatment,(Ti,Nb)O scale was formed and various morphological features appeared on the alloy *** electrochemical behavior of Ti−45Nb alloy in simulated body conditions was evaluated and showed that the alloy was highly resistant to corrosion deterioration regardless of additional laser surface modification ***,the improved corrosion resistance after laser treatment was evident(the corrosion current density of the alloy before laser irradiation was 2.84×10^(−8)A/cm2,while that after laser treatment with 5 mJ was 0.65×10^(−8)A/cm2)and ascribed to the rapid formation of a complex and passivating bi-modal surface oxide *** cytotoxicity and effects of the Ti−45Nb alloy laser surface modification on the mRC-5 cell viability,morphology,and proliferation were also *** Ti−45Nb alloy showed no cytotoxic ***,cells showed improved viability and adherence to the alloy surface after the laser irradiation *** highest average cell viability of 115.37%was attained for the alloy laser-irradiated with 15 *** showed that the laser surface modification can be successfully utilized to significantly improve alloy performance in a biological environment.

关键词： Ti−45Nb alloy laser surface scanning electrochemical properties biocompatibility cell morphology

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A review on transition metal oxides based photocatalysts for degradation of synthetic organic pollutants

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Journal of Environmental sciences 2024年第5期139卷 389-417页

作者： Athira Krishnan Anna swarnalal Divine Das midhina Krishnan Viswanathan s.saji smAshibli Department of Chemistry Amrita Vishwa VidyapeethamAmritapuriKerala690525India Interdisciplinary Research Center for Advanced materials King Fahd University of Petroleum&MineralsDhahran31261Saudi Arabia Department of Chemistry University of KeralaKariavattom CampusThiruvananthapuramKerala695581India

This review provides insight into the current research trend in transition metal oxides(TmOs)-based photocatalysis in removing the organic colouring matters from *** easy understanding,the research progress has been presented in four generations according to the catalyst composition and mode of application,viz:single component TmOs(the firstgeneration),doped TmOs/binary TmOs/doped binary TmOs(the second-generation),inactive/active support-immobilized TmOs(the third-generation),and ternary/quaternary compositions(the fourth-generation).The first two generations represent suspended catalysts,the third generation is supported catalysts,and the fourth generation can be suspended or *** review provides an elaborated comparison between suspended and supported catalysts,their general/specific requirements,key factors controlling degradation,and the methodologies for performance *** the plausible fundamental and advanced dye degradation mechanisms involved in each generation of catalysts were *** existing challenges in TmOs-based photocatalysis and how the researchers approach the hitch to resolve it effectively are *** research trends are also presented.

关键词： Photocatalysis Dye degradation Transition metal oxides and composites supported catalysts suspended catalysts

Effect of radiative loss mechanisms on FIR thermometric parameters of Nd^(3+)-doped lithium tellurite glasses

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Journal of Rare Earths 2024年第7期42卷 1250-1257,I0002页

作者： C.Y.morassuti A.P.L silva L.A.O.Nunes s.m.Lima L.H.C.Andrade Optical and Photothermal spectroscopy Group(GEOF) Center for Studies in Natural Resources(CERNA)State University of Mato Grosso do Sul(UEMS)C.P.351DouradosMSBrazil Renato Archer Information Technology Center Dom Pedro I Highway(SP-65)Km 1436-Chácaras Campos dos AmaraisCampinasSPBrazil Institute of Physics of são Carlos University of São PauloSão CarlosSPBrazil

Nd^(3+)-doped tellurite glasses are promising materials for thermometers based on the fluorescence intensity ratio(FIR)***,at high Nd^(3+)concentrations,energy transfer(ET)processes such as optical reabsorption and cross-relaxation can affect the Nd^(3+)emission,which has been little explored in the ***,the present work investigated the use of Nd^(3+)-doped tellurite glass(samples doped with Nd^(3+)at 0.2 mol%,0.5 mol%,2.0 mol%,and 4.0 mol%)in fluorescence thermometers,in the temperature range from 299 to 371 *** results indicate a strong dependence of the FIR parameters on the Nd^(3+)concentration,due to changes in the emission band profiles caused by optical reabsorption of the Nd^(3+)emissions and cross-relaxation processes.A decrease of the relative sensitivity of the ratio^(4)F_(5/2)→^(4)I_(9/2)/^(4)F_(3/2)→^(4)I_(9/2)is observed for samples doped with higher amounts of Nd^(3+).The maximum relative sensitivity at 299 K is 3.00%/K,which is the highest value among the reported Nd^(3+)ions.

关键词： Nd^(3+)-doped tellurite glass Fluorescence intensity ratio Optical thermometry Judd-Ofelt Rare earths

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Exact solutions for magnetohydrodynamic nanofluids flow and heat transfer over a permeable axisymmetric radially stretching/shrinking sheet

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Chinese Physics B 2024年第2期33卷 108-114页

作者： U.s.mahabaleshwar G.P.Vanitha L.m.Pérez Emad H.Aly I.Pop Department of studies in mathematics Davangere UniversityShivagangothriDavangereIndia Departamento de F´ısica FACIUniversidad de Tarapac´aCasilla 7DAricaChile Department of mathematics Faculty of EducationAin Shams UniversityRoxyCairoEgypt Department of mathematics Babes-Bolyai University400084 Cluj-NapocaRomania

We report on the magnetohydrodynamic impact on the axisymmetric flow of Al_(2)O_(3)/Cu nanoparticles suspended in H_(2)O past a stretched/shrinked *** the use of partial differential equations and the corresponding thermophysical characteristics of nanoparticles,the physical flow process is *** resultant nonlinear system of partial differential equations is converted into a system of ordinary differential equations using the suitable similarity *** transformed differential equations are solved *** of the magnetic parameter,solid volume fraction and stretching/shrinking parameter on momentum and temperature distribution have been analyzed and interpreted *** skin friction and Nusselt number were also *** addition,existence of dual solution was deduced for the shrinking sheet and unique solution for the stretching ***,Al_(2)O_(3)/H_(2)O nanofluid flow has better thermal conductivity on comparing with Cu/H_(2)O ***,it was found that the first solutions of the stream are stable and physically realizable,whereas those of the second ones are unstable.

关键词： magnetohydrodynamic nanofluid stretching/shrinking sheet axisymmetric flow analytical solution suction/injection

Towards Improving the Quality of Requirement and Testing Process in Agile software Development: An Empirical study

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Computers, materials and Continua 2024年第3期80卷 3761-3784页

作者： Ilays I. Hafeez Y. Almashfi N. Ali s. Humayun m. Aqib m. Alwakid G. University Institute of Information Technology Pir Mehr Ali Shah Arid Agriculture University Rawalpindi 46000 Pakistan Department of software Engineering College of Computer and Information Sciences Jouf University Al Jouf 72388 Saudi Arabia school of Arts Humanities and social sciences University of Roehampton London SW15 5PJ United Kingdom Department of Computer science College of Computer and Information Sciences Jouf University Al Jouf 72388 Saudi Arabia

software testing is a critical phase due to misconceptions about ambiguities in the requirements during specification, which affect the testing process. Therefore, it is difficult to identify all faults in software. As requirement changes continuously, it increases the irrelevancy and redundancy during testing. Due to these challenges; fault detection capability decreases and there arises a need to improve the testing process, which is based on changes in requirements specification. In this research, we have developed a model to resolve testing challenges through requirement prioritization and prediction in an agile-based environment. The research objective is to identify the most relevant and meaningful requirements through semantic analysis for correct change analysis. Then compute the similarity of requirements through case-based reasoning, which predicted the requirements for reuse and restricted to error-based requirements. Afterward, the apriori algorithm mapped out requirement frequency to select relevant test cases based on frequently reused or not reused test cases to increase the fault detection rate. Furthermore, the proposed model was evaluated by conducting experiments. The results showed that requirement redundancy and irrelevancy improved due to semantic analysis, which correctly predicted the requirements, increasing the fault detection rate and resulting in high user satisfaction. The predicted requirements are mapped into test cases, increasing the fault detection rate after changes to achieve higher user satisfaction. Therefore, the model improves the redundancy and irrelevancy of requirements by more than 90% compared to other clustering methods and the analytical hierarchical process, achieving an 80% fault detection rate at an earlier stage. Hence, it provides guidelines for practitioners and researchers in the modern era. In the future, we will provide the working prototype of this model for proof of concept. Copyright © 2024 The Authors. Publ

关键词： agile software development case-based reasoning Requirement prediction semantic analysis software testing

Interfacial stress engineering toward enhancement of ferroelectricity in Al doped HfO2 thin films

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CHINEsE PHYsICs B 2024年第9期33卷 637-643页

作者： Chen, s. X. Chen, m. m. Liu, Y. Cao, D. W. Chen, G. J. Jiangsu Univ Dept Microelect Zhenjiang 212013 Peoples R China Jiangsu Univ Dept Phys Zhenjiang 212013 Peoples R China Foshan Univ Guangdong Hong Kong Macao Joint Lab Intelligent Mi Foshan 528225 Peoples R China

Ferroelectric HfO2 has attracted much attention owing to its superior ferroelectricity at an ultra-thin thickness and good compatibility with si-based complementary metal-oxide-semiconductor (CmOs) technology. However, the crystallization of polar orthorhombic phase (o-phase) HfO2 is less competitive, which greatly limits the ferroelectricity of the as-obtained ferroelectric HfO2 thin films. Fortunately, the crystallization of o-phase HfO2 can be thermodynamically modulated via interfacial stress engineering. In this paper, the growth of improved ferroelectric Al doped HfO2 (HfO2:Al) thin films on (111)-oriented si substrate has been reported. structural analysis has suggested that nonpolar monoclinic HfO2:Al grown on (111)-oriented si substrate suffered from a strong compressive strain, which promoted the crystallization of (111)-oriented o-phase HfO2 in the as-grown HfO2:Al thin films. In addition, the in-plane lattice of (111)-oriented si substrate matches well with that of (111)-oriented o-phase HfO2, which further thermally stabilizes the o-phase HfO2. Accordingly, an improved ferroelectricity with a remnant polarization (2P(r)) of 26.7 mu C/cm(2) has been obtained. The results shown in this work provide a simple way toward the preparation of improved ferroelectric HfO2 thin films.

关键词： improved ferroelectricity interfacial stress engineering compressive strain HfO2 THERmAL-EXPANsION