Search results for "Anatase"

showing 10 items of 155 documents

Symmetry and models of single-walled TiO2 nanotubes with rectangular morphology

2011

Abstract The formalism of line symmetry groups for one-periodic (1D) nanostructures with rotohelical symmetry has been applied for symmetry analysis of single-walled titania nanotubes (SW TiO2 NTs) formed by rolling up the stoichiometric two-periodic (2D) slabs of anatase structure. Either six- or twelve-layer (101) slabs have been cut from TiO2 crystal in a stable anatase phase. After structural optimization, the latter keeps the centered rectangular symmetry of initial slab slightly compressed along a direction coincided with large sides of elemental rectangles. We have considered two sets of SW TiO2 NTs with optimized six- and twelve-layer structures, which possess chiralities (−n, n) an…

AnataseNanostructureMaterials scienceline groupsBand gaptio2 nanotubesPhysicsQC1-999Ab initiohybrid hf-dft pbe0 calculationsGeneral Physics and AstronomyNanotechnologyanatase structureMolecular physicsCondensed Matter::Materials ScienceReflection symmetryLinear combination of atomic orbitalsSlabrotohelical symmetryStoichiometryOpen Physics
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Partial photoelectrocatalytic oxidation of 3-pyridinemethanol by Pt, Au and Pd loaded TiO2 nanotubes on Ti plate

2021

Abstract The photoelectrocatalytic (PEC) oxidation of 3-pyridinemethanol to 3-pyridinemethanal and vitamin B3 was investigated by using Pt, Au and Pd loaded (as single or bimetallic) nanotube structured TiO2 on Ti plate in water under UVA irradiation. Nanotube structured TiO2 on Ti plate samples were prepared as anode by anodic oxidation method in ethylene glycol solution in different times, and then they were calcined at 500 °C to be obtained in crystalline form. The anodes were loaded with noble metals by electrochemical reduction method and characterized by XRD, XPS, SEM, and photocurrent techniques. The TiO2 on the plates was in the anatase phase. The loaded metals were in metallic form…

AnataseNanotubeMaterials science02 engineering and technologyGeneral Chemistry010402 general chemistry021001 nanoscience & nanotechnologyElectrochemistry01 natural sciencesCatalysis0104 chemical scienceslaw.inventionMetalchemistry.chemical_compoundchemistrylawvisual_artvisual_art.visual_art_mediumPhotocatalysisCalcination0210 nano-technologyBimetallic stripEthylene glycolNuclear chemistry
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Ab initiomodeling of sulphur doped TiO2nanotubular photocatalyst for water-splitting hydrogen generation

2012

In order to construct an efficient visible-light-driven TiO2 photocatalyst for water splitting applications, one has to perform improvements of its electronic structure. In this theoretical study we consider single-walled anatase TiO2 nanotubes having following morphologies: (101) 3-layered wall with chirality indexes (n,0) and (n,n), (101) 6-layered wall with (n,0) and (0,n), (001) 6-layered wall with (n,0) and (0,n), and (001) 9-layered wall with (n,0) and (0,n). The latter configuration occurs to be the most energetically stable, due to possessing negative strain energy. In our study the most stable 9-layered anatase (001) (0,n) nanotube has been doped with sulphur. According to obtained…

AnataseNanotubeMaterials scienceDopantDopingPhotocatalysisAb initioWater splittingPhysical chemistryNanotechnologyElectronic structureIOP Conference Series: Materials Science and Engineering
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Influence of pH on the degradation kinetics of nitrophenol isomers in a heterogeneous photocatalytic system

1993

Abstract The kinetics of photocatalytic degradation of 2-, 3- and 4-nitrophenol in aqueousdispersions containing TiO2 (anatase) has been investigated at different initial values of pH and concentrations of substrate. A pseudo-first order kinetics with respect to the nitrophenol concentration was found to hold; an increase of the substrate concentration and the initial pH was detrimental on the degradation rate.

AnataseNitrophenolchemistry.chemical_compoundDegradation kineticsChemistryProcess Chemistry and TechnologyKineticsInorganic chemistryPhotocatalysisSubstrate (chemistry)Degradation (geology)CatalysisCatalysisApplied Catalysis A: General
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Tailoring the Structural, Optical, and Photoluminescence Properties of Porous Silicon/TiO2 Nanostructures

2015

The structural, optical, and photoluminescence properties of porous silicon (PSi)/titanium dioxide (TiO2) nanostructures were investigated. PSi structures consisting of macro- and mesoporous layers were fabricated by metal-assisted chemical etching, and then TiO2 was introduced inside the PSi matrix using the atomic layer deposition technique. We performed scanning electron microscopy, transmission electron microscopy (TEM), X-ray diffraction, energy dispersive X-ray spectroscopy, Raman spectroscopy, ellipsometry, and photoluminescence (PL) spectroscopy to characterize the prepared and annealed PSi/TiO2 nanostructures. TEM and Raman analyses revealed that TiO2 had a crystalline anatase stru…

AnatasePhotoluminescenceMaterials scienceScanning electron microscopeAnalytical chemistryPorous siliconSurfaces Coatings and FilmsElectronic Optical and Magnetic MaterialsAtomic layer depositionsymbols.namesakeGeneral EnergyEllipsometrysymbolsPhysical and Theoretical ChemistrySpectroscopyRaman spectroscopyThe Journal of Physical Chemistry C
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Photoluminescence: A very sensitive tool to detect the presence of anatase in rutile phase electrospun TiO 2 nanofibers

2015

Abstract This paper reports on the synthesis and the characterization of titanium dioxide (TiO2) nanofibers prepared by electrospinning. The samples were annealed at various temperatures in air for 4 h. The as-spun and annealed TiO2/PVP composite nanofibers were characterized by scanning electron microscopy (SEM), Energy-dispersive X-ray spectroscopy analysis (EDX), X-ray diffraction (XRD), Raman spectroscopy and photoluminescence (PL). The results show that the heat treatment has an effect on the crystallization process. Even if the XRD data shows a complete anatase-to-rutile transition in the TiO2 nanofibers at 900 °C, photoluminescence reveals a small portion of anatase in rutile sample.…

AnatasePhotoluminescenceMaterials scienceScanning electron microscopeNanotechnology02 engineering and technology010402 general chemistry01 natural sciencessymbols.namesakechemistry.chemical_compound[CHIM]Chemical SciencesGeneral Materials ScienceElectrical and Electronic EngineeringComputingMilieux_MISCELLANEOUS021001 nanoscience & nanotechnologyCondensed Matter PhysicsElectrospinning0104 chemical scienceschemistryChemical engineeringRutileNanofiberTitanium dioxidesymbols0210 nano-technologyRaman spectroscopySuperlattices and Microstructures
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Rate of photon absorption and turnover number: two parameters for the comparison of heterogeneous photocatalytic systems in a quantitative way

1993

Abstract In order to correctly compare the performance of different photocatalytic systems using polycrystalline semiconductor oxides, two parameters are proposed: the rate of photon absorption (rpa) and the turnover number (tn). From these quantities the quantum yield (qy), which indicates the efficiency of the absorbed photons for promoting a reaction event, can be determined. The phenol photodegradation reaction, carried out in aqueous dispersions of polycrystalline TiO2 (anatase) of different preparation methods and sources, has been used as “test reaction” in order to determine the tn, rpa and qy values.

AnatasePhotonAqueous solutionChemistryInorganic chemistryAnalytical chemistryQuantum yieldTurnover numberInorganic ChemistryMaterials ChemistryPhotocatalysisPhysical and Theoretical ChemistryPhotodegradationAbsorption (electromagnetic radiation)Coordination Chemistry Reviews
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ChemInform Abstract: Rate of Photon Absorption and Turnover Number: Two Parameters for the Comparison of Heterogeneous Photocatalytic Systems in a Qu…

2010

Abstract In order to correctly compare the performance of different photocatalytic systems using polycrystalline semiconductor oxides, two parameters are proposed: the rate of photon absorption (rpa) and the turnover number (tn). From these quantities the quantum yield (qy), which indicates the efficiency of the absorbed photons for promoting a reaction event, can be determined. The phenol photodegradation reaction, carried out in aqueous dispersions of polycrystalline TiO2 (anatase) of different preparation methods and sources, has been used as “test reaction” in order to determine the tn, rpa and qy values.

AnatasePhotonChemistryAnalytical chemistryPhotocatalysisQuantum yieldGeneral MedicineCrystallitePhotodegradationAbsorption (electromagnetic radiation)Turnover numberChemInform
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A recipe for the use of rutile in sedimentary provenance analysis

2012

Abstract Rutile has received considerable attention in the last decade as a valuable petrogenetic indicator mineral. Based on both new and previously published data, we carve out advantages and pitfalls regarding TiO 2 -minerals in sedimentary provenance analysis. This results in a recipe for the use of rutile in provenance studies. The main points are: Rutile geochemistry from different grain size fractions does not differ systematically, and hence rutiles should be extracted from the fraction containing the most rutile grains (usually 63–200 μm). Similarly, different magnetic susceptibility of rutile does not systematically imply different trace element composition. Before interpretation …

AnataseProvenanceMineral010504 meteorology & atmospheric sciencesBrookiteStratigraphyMetamorphic rockMineralogyGeology010502 geochemistry & geophysics01 natural sciencesMagnetic susceptibilityGrain sizeRutilevisual_artvisual_art.visual_art_mediumGeology0105 earth and related environmental sciencesSedimentary Geology
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Highly stable defective TiO2-x with tuned exposed facets induced by fluorine: Impact of surface and bulk properties on selective UV/visible alcohol p…

2020

Abstract Titanium dioxide samples were prepared in the presence of different amounts of fluorine via hydrothermal method. It has been found that the presence of fluoride influenced the physico-chemical properties of TiO2 in various ways as polymorphic form stability, surface hydroxylation, generation of hydroxyl radicals under irradiation and formation of Ti3+ centers and oxygen vacancies. The generation rate of OH radicals was investigated by the photoluminescence technique in the presence of terephthalic acid. X-ray diffractometry indicated that fluorine stabilized the anatase TiO2. X-Ray photoelectron spectroscopy (XPS) revealed the presence of fluorine on the surface and the shift of th…

AnataseRadical2General Physics and Astronomychemistry.chemical_elementPhotochemistry)law.inventionchemistry.chemical_compoundX-ray photoelectron spectroscopylawTiOFluorine effectIrradiationElectron paramagnetic resonanceStructural and morphological TiOChemistrySurfaces and InterfacesGeneral ChemistryOH radicals generation rateTitanium dioxide (TiOCondensed Matter PhysicsSurfaces Coatings and Films2-Propanol and 4-Methoxybenzyl alcohol photo-oxidationTitanium dioxidefacetPhotocatalysisFluorinecontrol[rad]Applied Surface Science
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