Search results for " Optics"

showing 10 items of 5880 documents

Two- and three-state conical intersections in the electron capture dissociation of disulfides: The importance of multireference calculations

2011

The SS bond cleavage produced upon electron attachment to disulfides was generally assumed to be an adiabatic process because the added electron occupies the σ*(SS) antibonding orbital. This is clearly the case in the parent HSSH compound, but not necessarily in XSSX′ derivatives, where the substituents X and X′ are different. Through the use of MS-CASPT2 calculations, we have shown that the dissociation of the SS two-center-three-electron bond in these asymmetric XSSX′ compounds requires the interaction of at least two states, in order to localize the extra electron in one of the fragments upon dissociation. This is actually the case for the CH3SSNH2 derivative, where the most favorable di…

Electron-capture dissociationAb initio quantum chemistry methodsChemistryComputational chemistryElectron captureElectronPhysical and Theoretical ChemistryConical intersectionCondensed Matter PhysicsAntibonding molecular orbitalAtomic and Molecular Physics and OpticsDissociation (chemistry)Bond cleavageInternational Journal of Quantum Chemistry
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Photoconductivity & photoelectron emission of LiGaO2 crystal excited in intrinsic absorption range

2019

This research is funded by the Latvian Council of Science, project “Research of luminescence mechanisms and dosimeter properties in prospective nitrides and oxides using TL and OSL methods], project No. lzp-2018/0361.

Electronic structureMaterials sciencePhotoconductivityExcitonLiGaO2 crystal02 engineering and technologyElectronPhoton energy010402 general chemistry01 natural sciences7. Clean energyInorganic ChemistryComputer Science::Systems and Control:NATURAL SCIENCES:Physics [Research Subject Categories]Electrical and Electronic EngineeringPhysical and Theoretical ChemistryPhotoluminescenceSpectroscopyPhotoelectron emissionOrganic ChemistryVacuum ultravioletPhotoelectric effect021001 nanoscience & nanotechnologyAtomic and Molecular Physics and Optics0104 chemical sciencesElectronic Optical and Magnetic MaterialsAbsorption bandExcited stateDember effectCharge carrierAtomic physics0210 nano-technologyOptical Materials
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Linear and nonlinear optical properties of a series of Ni-dithiolene derivatives

2009

Some linear and nonlinear optical (NLO) properties of Ni(SCH)4 and several of its derivatives have been computed by employing a series of basis sets and a hierarchy of methods (e.g., HF, DFT, coupled cluster, and multiconfigurational techniques). The electronic structure of Ni(SCH)4 has been also analyzed by using CASSCF/CASPT2, ab initio valence bond, and DFT methods. In particular we discuss how the diradicaloid character (DC) of Ni(SCH)4 significantly affects its NLO properties. The quasidegeneracy of the two lowest-energy singlet states 1 mathg and 1 math1u, the clear DC nature of the former, and the very large number of low-lying states enhance the NLO properties values. These particul…

Electronic structureNonlinear opticsSeries (mathematics)Optical propertiesChemistryAb initioGeneral Physics and AstronomyNonlinear opticsElectronic structureAb initio calculations ; Electronic structure ; Nonlinear optics ; Optical materials ; Optical properties ; Organic compounds ; VB calculationsUNESCO::FÍSICA::Química físicaCoupled clusterVB calculationsAb initio quantum chemistry methodsComputational chemistryOptical materialsOrganic compoundsPhysical chemistryValence bond theorySinglet stateAb initio calculationsPhysical and Theoretical Chemistry:FÍSICA::Química física [UNESCO]
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Asymmetries in the momentum distributions of electrons stripped by a XUV chirped pulse in the presence of a laser field

2012

The ionization of hydrogen by a chirped XUV pulse in the presence of a few cycle infrared laser pulse has been investigated. The electron momentum distribution has been obtained by treating the interaction of the atom with the XUV radiation at the first order of the time-dependent perturbation theory and describing the emitted electron through the Coulomb-Volkov wavefunction. The results of the calculations agree with the ones found by solving numerically the time-dependent Schr¨odinger equation. It has been found that depending on the delay between the pulses the combined effect of the XUV chirp and of the steering action on the infrared field brings about asymmetries in the electron momen…

ElectronsElectronSettore FIS/03 - Fisica Della Materialaw.inventionMomentumElectron TransportOpticslawIonizationPhysics::Atomic and Molecular ClustersChirpComputer SimulationPhysics::Atomic PhysicsPhysicsbusiness.industryLasersFar-infrared laserPulse durationLaserStrong-field processes Ultrafast opticsAtomic and Molecular Physics and OpticsPulse (physics)Energy TransferModels ChemicalAstrophysics::Earth and Planetary AstrophysicsAtomic physicsbusiness
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Dimensionality Controls Anion Intermixing in Electroluminescent Perovskite Heterojunctions.

2022

Metal halide perovskites have emerged as a promising group of materials for optoelectronic applications such as photovoltaics, light emission, and photodetectors. So-far, in particular, the stability of light-emitting devices is limited, which is in part attributed to the intrinsic ionic conductivity of these materials. High-performance devices inevitably contain heterojunctions similar to other optoelectronic devices based on oxide perovskites, II-VI, or III-V group semiconductors. To enable efficient heterojunctions, ion exchange at the interface between different layers should be controlled. Herein, we report a method that enables to control and monitor the extent of anion intermixing be…

ElectroquímicaElectrical and Electronic EngineeringAtomic and Molecular Physics and OpticsBiotechnologyElectronic Optical and Magnetic MaterialsACS photonics
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Transparent Light‐Emitting Electrochemical Cells

2022

Single layer light-emitting electrochemical cells (LECs) are amongst the simplest electroluminescent devices and operate with air-stable electrodes. Transparent light-emitting devices are of great interest as they can enable new applications in consumer electronics. In this work, a transparent ionic transition metal complex based LEC is fabricated by developing a transparent top contact based on tin (IV) oxide (SnO2) and indium-tin oxide, processed by low-temperature atomic layer deposition and pulsed laser deposition, respectively. The resulting devices present transparency in excess of 75% over the full visible spectrum (380-750 nm), with 82% transmission at the emission peak (563 nm). Th…

ElectroquímicaMaterialsAtomic and Molecular Physics and OpticsElectronic Optical and Magnetic MaterialsAdvanced Optical Materials
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Sensitization of nanocrystalline TiO2 with 3,4,9,10-perylene tetracarboxylic acid

2014

Optical properties of 3,4,9,10-perylene tetracarboxylic acid (PTCA) in the presence of nanocrystalline TiO2 (nominal diameter 15 nm) have been investigated in ethanol solution and in the solid state by UV-Vis absorption spectroscopy and steady-state and time-resolved fluorescence. Experimental results show that, in ethanol, the presence of TiO2 nanoparticles causes significant changes in the typical absorption and fluorescence bands of PTCA and in the fluorescence relaxation time. Similar effects are also detected in solid samples, obtained by electrospray deposition technique. The nonlinear optical properties of the PTCA-TiO2 in ethanol solutions were investigated using the single-beam Z-s…

ElectrosprayMaterials scienceAbsorption spectroscopyAnalytical chemistryBioengineeringchemistry.chemical_compoundGeneral Materials ScienceTitania nanoparticles Dye sensitization Absorption and fluorescence spectroscopies Optical limiting Z-scan methodDeposition (law)Settore CHIM/02 - Chimica FisicaZ-scan methodTitania nanoparticles; Dye sensitization; Absorption and fluorescence spectroscopies; Optical limiting; Z-scan methodDye sensitizationGeneral ChemistryCondensed Matter PhysicsFluorescenceAtomic and Molecular Physics and OpticsNanocrystalline materialchemistryModeling and SimulationAbsorption (chemistry)Optical limitingLuminescenceTitania nanoparticlesPeryleneAbsorption and fluorescence spectroscopiesJournal of Nanoparticle Research
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Improvement of the thermal emissivity calculated with the vegetation cover method by using optical atmospherically corrected images

2007

In this paper we assess the influence caused by the lack of atmospheric correction of the optical images used to calculate land surface emissivity (LSE). When thermal emissivity is determined by the Vegetation Cover Method (VCM), information from the solar spectrum in order to calculate the vegetation cover fraction is required. The atmospheric correction is performed in this research by using the combination of the Dark Dense Vegetation method (DDV) and the Second Simulation of the Satellite Signal in the Solar Spectrum (6S) code. The methodology was applied to a Landsat TM image of Tomelloso, Spain. It was determined that the emissivity between 10 and 12 mum only increases 0.4% (which rep…

EmissivityAtmospheric correctionEnvironmental scienceSatelliteVegetationAtmospheric modelAtmospheric sciencesSignalAtmospheric opticsRemote sensingVegetation cover2007 IEEE International Geoscience and Remote Sensing Symposium
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Comparison Between Fractional Vegetation Cover Retrievals from Vegetation Indices and Spectral Mixture Analysis: Case Study of PROBA/CHRIS Data Over …

2009

Abstract: In this paper we compare two different methodologies for Fractional Vegetation Cover (FVC) retrieval from Compact High Resolution Imaging Spectrometer (CHRIS) data onboard the European Space Agency (ESA) Project for On-Board Autonomy (PROBA) platform. The first methodology is based on empirical approaches using Vegetation Indices (VIs), in particular the Normalized Difference Vegetation Index (NDVI) and the Variable Atmospherically Resistant Index (VARI). The second methodology is based on the Spectral Mixture Analysis (SMA) technique, in which a Linear Spectral Unmixing model has been considered in order to retrieve the abundance of the different constituent materials within pixe…

Endmember010504 meteorology & atmospheric sciencesMean squared error0211 other engineering and technologies550 - Earth sciences02 engineering and technologyLand coverlcsh:Chemical technology01 natural sciencesBiochemistryNormalized Difference Vegetation IndexArticleCHRISAnalytical ChemistryRoot mean squareFractional Vegetation Cover; Vegetation Indices; Spectral Mixture Analysis; PROBA; CHRISPROBAlcsh:TP1-1185Electrical and Electronic EngineeringInstrumentation021101 geological & geomatics engineering0105 earth and related environmental sciencesMathematicsRemote sensingFractional Vegetation CoverPixelVegetation15. Life on landAtomic and Molecular Physics and OpticsStandard errorSpectral Mixture AnalysisVegetation Indices
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Photovoltaic Devices Using Sublimed Methylammonium Lead Iodide Perovskites: Long‐Term Reproducible Processing

2023

Energy Engineering and Power TechnologyElectrical and Electronic EngineeringAtomic and Molecular Physics and OpticsElectronic Optical and Magnetic MaterialsSolar RRL
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