Search results for "Kite"

showing 10 items of 1123 documents

Proton sponge lead halides containing 1D polyoctahedral chains

2021

Hybrid one-dimensional lead halides, containing the protonated 1,8-bis(dimethylamino)naphthalene moiety (C14H19N2, monoprotonated "proton sponge"), were prepared by simple one-pot methods and investigated in terms of crystal structure, morphology, thermal stability and electronic properties. The as-precipitated (C14H19N2)PbBr3 and (C14H19N2)PbI3 species are isostructural and crystallize in the orthorhombic Pbca space group, resulting in 1D crystal phases with ([PbX3](-))(infinity) chains (built by face-sharing [PbX6] octahedra; X = Br, I), among which the (C14H19N2)(+) cations are inserted. The two compounds display complete miscibility in the solid state: both (C14H19N2)PbI2Br and (C14H19N…

Materials science1D-pseudo perovskiteBand gapGeneral ChemistryCrystal structureCondensed Matter PhysicsCrystalhybrid lead halides trimethylsulfoxonium powder diffraction solid solution ionic defectivity periodic DFT calculationsCrystallographyOctahedronPhase (matter)General Materials ScienceOrthorhombic crystal systemThermal stabilityIsostructuralCrystEngComm
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Theoretical and Experimental Study of (Ba,Sr)TiO 3 Perovskite Solid Solutions and BaTiO 3 /SrTiO 3 Heterostructures

2019

This study was supported by the ERA-NET HarvEnPiez project. The authors would like to thank their national funding agencies (Latvian State Education Development Agency, Slovenian Ministry of Higher Education, Science and Technology, Romanian National Authority for Scientific Research and Innovation, CCCDI-UEFISCDI, project number 49/2016 within PNCDI III – M-ERA NET Program).

Materials science4. EducationAb initioThermodynamics02 engineering and technology010402 general chemistry021001 nanoscience & nanotechnology01 natural sciencesFerroelectricity0104 chemical sciencesSurfaces Coatings and FilmsElectronic Optical and Magnetic MaterialsHybrid functionalCondensed Matter::Materials ScienceTetragonal crystal systemGeneral EnergyLinear combination of atomic orbitals:NATURAL SCIENCES:Physics [Research Subject Categories]Density functional theoryPhysical and Theoretical Chemistry0210 nano-technologyPerovskite (structure)Solid solutionThe Journal of Physical Chemistry C
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Charge injection and trapping at perovskite interfaces with organic hole transporting materials of different ionization energies

2019

The extraction of photogenerated holes from CH3NH3PbI3 is crucial in perovskite solar cells. Understanding the main parameters that influence this process is essential to design materials and devices with improved efficiency. A series of vacuum deposited hole transporting materials (HTMs) of different ionization energies, used in efficient photovoltaic devices, are studied here by means of femtosecond transient absorption spectroscopy. We find that ultrafast charge injection from the perovskite into the different HTMs (<100 fs) competes with carrier thermalization and occurs independently of their ionization energy. Our results prove that injection takes place from hot states in the valence…

Materials science530 Physicslcsh:Biotechnology02 engineering and technologyElectronTrapping7. Clean energy01 natural sciencesVacuum depositionlcsh:TP248.13-248.65540 Chemistry0103 physical sciencesUltrafast laser spectroscopyGeneral Materials ScienceMaterialsPerovskite (structure)010302 applied physicsGeneral EngineeringCarrier lifetime021001 nanoscience & nanotechnologylcsh:QC1-999SemiconductorsChemical physicsFemtosecondIonization energy0210 nano-technologylcsh:PhysicsAPL Materials
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Perovskite nanoparticles : synthesis, properties, and novel applications in photovoltaics and LEDs

2018

Solar cells and light-emitting diodes (LEDs) based on metal-halide perovskites are transitioning from promising performers to direct competitors to well-established technologies, with cost-effectiveness as a strong advantage. Nanostructured perovskites have yielded record LEDs due to their higher versatility in the local management of charge carriers, which has enabled photoluminescence quantum yields (PLQYs) close to 100%. However, these perovskite nanostructures are yet to be fully exploited in other applications such as photovoltaics, where they can also present competitive advantages as they enable feasible routes to surpass the Shockley–Queisser limit by means of multiexciton generatio…

Materials science:Materials [Engineering]business.industryNanoparticleNanotechnology02 engineering and technologyGeneral Chemistry010402 general chemistry021001 nanoscience & nanotechnology01 natural sciences0104 chemical scienceslaw.inventionPhotovoltaicslawLight EmissionDimensionalityGeneral Materials ScienceLight emission0210 nano-technologybusinessPerovskite (structure)Light-emitting diode
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Ab initio calculations of ABO3 perovskite (001), (011) and (111) nano-surfaces, interfaces and defects

2020

We carried out ab initio calculations for technologically important ABO3 perovskite, such as, SrTiO3, BaTiO3, SrZrO3 and PbZrO3 (001), (011) and (111) nano-surfaces, interfaces and bulk [Formula: see text]-centers. For SrTiO3, BaTiO3, SrZrO3 and PbZrO3 (001) nano-surfaces, as a rule, all first surface layer atoms relax inward, whereas all second layer atoms relax outward, and, typically, all third surface layer atoms, again, relax inward. Calculated (001) surface energies for SrTiO3, BaTiO3, SrZrO3 and PbZrO3 perovskites are almost equal for both BO2 and AO-terminations, and always smaller than the (011) and (111) surface energies. We discussed the results of our ab initio calculations dea…

Materials scienceAb initio quantum chemistry methodsChemical physicsNano-Statistical and Nonlinear Physics02 engineering and technology010402 general chemistry021001 nanoscience & nanotechnology0210 nano-technologyCondensed Matter Physics01 natural sciences0104 chemical sciencesPerovskite (structure)Modern Physics Letters B
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Ab initio simulation of (Ba,Sr)TiO3 and (Ba,Ca)TiO3 perovskite solid solutions

2019

Abstract The results of ab initio (first-principles) computations of structural, elastic and piezoelectric properties of Ba(1−x)SrxTiO3 (BSTO) and Ba(1−x)CaxTiO3 (BCTO) perovskite solid solutions are presented, discussed and compared. Calculations are performed with the CRYSTAL14 computer code within the linear combination of atomic orbitals (LCAO) approximation, using advanced hybrid functionals of the density-functional-theory (DFT). Supercell model allows us to simulate solid solutions with different chemical compositions (x = 0, 0.125 and 0.25) within ferroelectric tetragonal phases (x

Materials scienceAb initio02 engineering and technologyGeneral Chemistry010402 general chemistry021001 nanoscience & nanotechnologyCondensed Matter Physics01 natural sciencesMolecular physicsFerroelectricity0104 chemical sciencesHybrid functionalTetragonal crystal systemLinear combination of atomic orbitalsSupercell (crystal)General Materials Science0210 nano-technologyPerovskite (structure)Solid solutionSolid State Ionics
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Laser-Calorimetric Study of Fundamental Absorption Edge in Pb,La(ZrTi)O3 (PLZT) Perovskite Ceramics

2000

The values of the light absorption coefficient of PLZT 10/65/35 ceramics at selected wavelengths have been obtained by laser calorimetric measurements. The absorption coefficient of the PLZT ceramics is an exponential function of the photon energy. Two values of characteristic Urbach energy have been found ΔE1 = 106 meV and ΔE2 = 238 meV. The first one is a characteristic of the potential of electron-phonon interaction of the optically excited transitions from the valence band to the conduction band and does not depend on lattice defects or admixtures. The other characterises the electron-phonon interaction at optical transitions between two localized electron states in the energy gap separ…

Materials scienceAbsorption edgeBand gapAtomic electron transitionAbsorption bandExcited stateAttenuation coefficientMineralogyAtomic physicsPhoton energyPerovskite (structure)
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CO2 laser-induced structure changes in lead zirconate titanate Pb(Zr0.58Ti0.42)O3 sol–gel films

2003

Based on absorption spectra of lanthanum modified lead zirconate titanate Pb0.9La0.1(Zr0.65Ti0.35)O3 (PLZT10/65/35) ferroelectric ceramics an idea of local and selective treatment of lead zirconite titanate Pb(ZrXTi1−X)O3 (PZT) sol–gel film in the multi-layer structure by CO2 laser radiation was formulated. The possibility to obtain PZT perovskite film on the SiO2/Si substrate by irradiation with CO2 laser was shown experimentally. X-ray studies revealed the PZT perovskite structure ratio growth at the expenses of pirochlore structure with an increased power density of laser radiation.

Materials scienceAbsorption spectroscopyFerroelectric ceramicsGeneral Physics and Astronomychemistry.chemical_elementMineralogySurfaces and InterfacesGeneral ChemistryCondensed Matter PhysicsLead zirconate titanateLaserTitanateSurfaces Coatings and Filmslaw.inventionchemistry.chemical_compoundchemistrylawLanthanumComposite materialSol-gelPerovskite (structure)Applied Surface Science
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Room-Temperature Cubic Phase Crystallization and High Stability of Vacuum-Deposited Methylammonium Lead Triiodide Thin Films for High-Efficiency Sola…

2019

Methylammonium lead triiodide (MAPI) has emerged as a high-performance photovoltaic material. Common understanding is that at room temperature it adopts a tetragonal phase and it only converts to the perfect cubic phase around 50-60 ºC. Most MAPI films are prepared using a solution-based coating process, yet they can also be obtained by vapor phase deposition methods. Vapor phase processed MAPI films have significantly different characteristics compared to their solvent processed analogous, such as a relatively small crystal grain sizes and short excited state lifetimes. Yet solar cells based on vapor phase processed MAPI films exhibit high power conversion efficiencies. Surprisingly, after…

Materials scienceAnalytical chemistry02 engineering and technologyCubic crystal system010402 general chemistry7. Clean energy01 natural scienceslaw.inventionchemistry.chemical_compoundTetragonal crystal systemlawPhase (matter)Deposition (phase transition)General Materials ScienceThin filmTriiodideCrystallizationMaterialsCèl·lules fotoelèctriquesPerovskite (structure)Mechanical Engineering021001 nanoscience & nanotechnology0104 chemical scienceschemistryMechanics of Materials0210 nano-technology
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LPE growth and study of the Ce3+ incorporation in LuAlO3:Ce single crystalline film scintillators

2019

This work reports the results of the optical and electron paramagnetic resonance (EPR) investigation of the Ce3+ incorporation in single crystalline film (SCF) scintillators of Ce-doped LuAlO3 perovskite, grown by the liquid phase epitaxy method onto YAlO3 substrates using a PbO–B2O3 flux. The absorption, luminescence and EPR spectra showed the presence of the main Ce3+ center type (CeLu) corresponding to the location of Ce3+ ions in the twelve-fold coordinated cuboctahedral positions of the LuAlO3 host. Also the dimer CeLu–CeLu centers were found in the EPR spectra of the LuAP:Ce SCFs. No EPR spectrum of the Ce3+ ions located in the octahedral positions of Al3+ cations has been detected in…

Materials scienceAnalytical chemistry02 engineering and technologyGeneral Chemistry010402 general chemistry021001 nanoscience & nanotechnologyCondensed Matter PhysicsEpitaxy01 natural sciences0104 chemical scienceslaw.inventionIonOctahedronlawGeneral Materials ScienceAbsorption (chemistry)0210 nano-technologyElectron paramagnetic resonanceLuminescenceHyperfine structurePerovskite (structure)CrystEngComm
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