Search results for " Perovskites."

showing 6 items of 26 documents

Tendencies in ABO3 Perovskite and SrF2, BaF2 and CaF2 Bulk and Surface F-Center Ab Initio Computations at High Symmetry Cubic Structure

2021

This research was partly funded by the Latvian Council of Science project No. LZP‐ 2020/2‐0009 (for R. Eglitis), as well as the ERAF Project No. 1.1.1.1/18/A/073. We express our gratitude for the financial support from Latvian–Ukraine cooperation Project No. Latvia–Ukraine LV‐ UA/2021/5. The Institute of Solid State Physics, University of Latvia (Latvia), as the Centre of Excellence has received funding from the European Unions Horizon 2020 Framework Pro‐ gramme H2020‐WIDESPREAD01‐2016‐2017‐Teaming Phase2 under Grant Agreement No. 739508, project CAMART2.

Surface (mathematics)B3LYPMaterials sciencePhysics and Astronomy (miscellaneous)General Mathematicschemistry.chemical_element02 engineering and technologyABO3 high symmetry cubic perovskites01 natural sciencesElectric chargeMolecular physicsABO<sub>3</sub> high symmetry cubic perovskitesab initio computationsVacancy defect0103 physical sciencesQA1-939Computer Science (miscellaneous)010306 general physicsPerovskite (structure)<i>F</i>-centerCharge (physics)F‐center021001 nanoscience & nanotechnologySymmetry (physics)B3PWchemistryChemistry (miscellaneous):NATURAL SCIENCES [Research Subject Categories]FluorineAb initio computationsAb initio computations0210 nano-technologyMathematicsSymmetry
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Doping induced stable room temperature dual emission from gadolinium doped vacancy ordered double halide perovskite, Gd:Cs2SnCl6

2022

The recent advancement in bandgap engineering through controlled doping has widen the prospectof vacancy ordered double halide perovskites (VO DHPs) by conferring them with designableoptoelectronic properties. Here, we report synthesis of Gd doped Cs2SnCl6 via a simplesolvothermal method. Gd3+ ions doping lowers the band gap from 3.8 eV to 2.8 eV and facilitatesstable room temperature dual PL emission centered at 440 nm and 610 nm. The macroscopicemission process is well supported by the confocal PL emission studies on isolated crystallites.Both the pristine (Cs2SnCl6) and Gd:Cs2SnCl6 exhibit crystalline cubic structure with Fm3m spacegroup. Rietveld refinement correlates well with the cubi…

band gap engineering[CHIM.MATE] Chemical Sciences/Material chemistryphotoluminescence (PL) emissionconfocal PL spectroscopyvacancy ordered (VO) double halide perovskites (DHP)
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Modeling bismuth insertion in 1D hybrid lead halide TMSO(Pb x Bi y )I3 pseudo-perovskites

2022

Abstract The structures of the disordered 1D (pseudo-)perovskites of general TMSO(Pb x Bi y )I3 formulation [TMSO = (CH3)3SO+], obtained by doping the TMSOPbI3 species with Bi3+ ions, are investigated through the formulation of a statistical model of correlated disorder, which addresses the sequences of differently occupied BI6 face-sharing octahedra (B = Pb, Bi or vacant site) within ideally infinite [(BI3)−] n chains. The x-ray diffraction patterns simulated on the basis of the model are matched to the experimental traces, which show many broad peaks with awkward (nearly trapezoidal) shapes, under the assumption that the charge balance is fully accomplished within each chain. The analysis…

lead halideMechanical EngineeringBioengineeringGeneral Chemistryaliovalent dopingface-sharing octahedraXRD whole pattern simulation; aliovalent doping; face-sharing octahedra; hybrid perovskites; lead halide; structural disorderSettore CHIM/03 - Chimica Generale E Inorganicastructural disorderMechanics of MaterialsXRD whole pattern simulationGeneral Materials ScienceElectrical and Electronic Engineeringhybrid perovskitesNanotechnology
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Purcell Enhancement and Wavelength Shift of Emitted Light by CsPbI3 Perovskite Nanocrystals Coupled to Hyperbolic Metamaterials

2020

Manipulation of the exciton emission rate in nanocrystals of lead halide perovskites (LHPs) was demonstrated by means of coupling of excitons with a hyperbolic metamaterial (HMM) consisting of alternating thin metal (Ag) and dielectric (LiF) layers. Such a coupling is found to induce an increase of the exciton radiative recombination rate by more than a factor of three due to the Purcell effect when the distance between the quantum emitter and HMM is nominally as small as 10 nm, which coincides well with the results of our theoretical analysis. Besides, an effect of the coupling-induced long wavelength shift of the exciton emission spectrum is detected and modeled. These results can be of i…

light−matter interactionMaterials scienceperovskite nanocrystalsExcitonphotonicsPhysics::Optics02 engineering and technologyDielectricPurcell effectPurcell factor01 natural sciences7. Clean energyMolecular physics010309 opticsCondensed Matter::Materials Science0103 physical sciencesSpontaneous emissionEmission spectrumElectrical and Electronic EngineeringPerovskite (structure)business.industryCondensed Matter::Otherlight-matter interactionMetamaterial021001 nanoscience & nanotechnologyCondensed Matter::Mesoscopic Systems and Quantum Hall EffectAtomic and Molecular Physics and OpticsElectronic Optical and Magnetic Materialslead halide perovskiteshyperbolic metamaterials (HMMs)Photonics0210 nano-technologybusinessBiotechnology
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On the Way to Optoionics

2020

Discussions with Michael Grätzel, Ursula Röthlisberger, Robert A. Evarestov and Bettina V. Lotsch are gratefully acknowledged.

materials scienceChemistryOrganic Chemistry:NATURAL SCIENCES::Physics [Research Subject Categories]Nanotechnologyoptoionics02 engineering and technologysolid state ionics010402 general chemistry021001 nanoscience & nanotechnology01 natural sciencesBiochemistryCatalysis0104 chemical sciencesInorganic ChemistrySolid state ionicslead halide perovskitesDrug Discoveryion conductivityPhysical and Theoretical Chemistry0210 nano-technologyphotoelectrochemical devicesHelvetica Chimica Acta
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Optoelectronic devices based on caesium lead halide perovskite nanocrystals

2020

Tradicionalmente, la implementación de materiales activos en circuitos fotónicos integrados se ha basado en la utilización de semiconductores III-V y vidrios y materiales ferroeléctricos dopados con iones de tierras raras. Sin embargo, en la actualidad existe una alternativa basada en (nano) materiales sintetizados por técnicas de química coloidal. La posibilidad de procesar nanomateriales en solución permite fabricar semiconductores con propiedades ópticas (emisión, absorción, dispersión de luz) que pueden diseñarse durante la síntesis. Además, su naturaleza coloidal permite integrarlas en cualquier arquitectura óptica mediante sencillas técnicas de impresión en tinta. En este contexto, lo…

nanotechnologyperovskite nanocrystalsoptoelectronicsHollow-core fibersUNESCO::FÍSICAIntegrated opticsperovskite materialscharge transportamplified spontaneous emissionlead halide perovskitesphoton recycling:FÍSICA [UNESCO]optical gain
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