Search results for "Electron transition"

showing 10 items of 58 documents

Rationalisation of the Optical Signatures of nor-Dihydroxanthene-Hemicyanine Fused Near-Infrared Fluorophores By First Principle Tools

2018

Using a computational approach combining the Time-Dependent Density Functional Theory (TD-DFT) and the second-order Coupled Cluster (CC2) approaches, we investigate the spectral properties of a large panel of nor-dihydroxanthene (DHX)-hemicyanine fused dyes. First we compare the theoretical and experimental 0-0 energies for a set of 14 known synthetic compounds and show that a remarkable agreement between theory and experiment is obtained when a suitable environmental model is selected. In addition, we obtain vibrationally-resolved spectra for several compounds and theory also accurately reproduces the experimental band shapes. We show that the electronic transitions in nor-DHX-based fluoro…

Physics010304 chemical physicsSeries (mathematics)Near-infrared spectroscopyGeneral Physics and Astronomy010402 general chemistry01 natural sciencesMolecular physicsSpectral line3. Good health0104 chemical sciences[CHIM.THEO]Chemical Sciences/Theoretical and/or physical chemistryDipoleCoupled clusterAtomic electron transition[ CHIM.THEO ] Chemical Sciences/Theoretical and/or physical chemistry0103 physical sciencesFirst principleDensity functional theoryPhysical and Theoretical ChemistryComputingMilieux_MISCELLANEOUS
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Controlled type-I–type-II transition in GaAs/AlAs/AlxGa1−xAs double-barrier quantum wells

1997

We show that the insertion of extremely narrow AlAs layers in double-barrier GaAs/AlAs/${\mathrm{Al}}_{\mathrm{x}}$${\mathrm{Ga}}_{1\mathrm{\ensuremath{-}}\mathrm{x}}$As quantum wells results in a variety of electronic configurations, thus providing a powerful tool for tailoring the electronic transitions in GaAs heterostructures. In particular, the transition from type-I to type-II recombination is shown to occur in correspondence with variations by a single monolayer in the thickness of the AlAs and/or GaAs layers. Drastic changes in the recombination lifetimes are correspondingly observed; at the same time, the photoluminescence efficiency is found to be almost independent of the type-I-…

PhysicsCondensed Matter::Materials ScienceX-ray absorption spectroscopyPhotoluminescenceCondensed matter physicsAtomic electron transitionMonolayerHeterojunctionElectron configurationType (model theory)Condensed Matter::Mesoscopic Systems and Quantum Hall EffectQuantum wellPhysical Review B
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Dynamical Casimir-Polder interaction between an atom and surface plasmons

2013

We investigate the time-dependent Casimir-Polder potential of a polarizable two-level atom placed near a surface of arbitrary material, after a sudden change in the parameters of the system. Different initial conditions are taken into account. For an initially bare ground-state atom, the time-dependent Casimir-Polder energy reveals how the atom is "being dressed" by virtual, matter-assisted photons. We also study the transient behavior of the Casimir-Polder interaction between the atom and the surface starting from a partially dressed state, after an externally induced change in the atomic level structure or transition dipoles. The Heisenberg equations are solved through an iterative techni…

PhysicsCondensed Matter::Quantum GasesQuantum PhysicsSurface plasmons.Surface plasmonInstitut für Physik und AstronomieFOS: Physical sciencesInteraction energySurface plasmon polaritonAtomic and Molecular Physics and OpticsDynamical Casimir-Polder interactionCasimir effectAtom laserAtomic electron transitionQuantum mechanicsAtomQuasiparticlePhysics::Atomic and Molecular ClustersPhysics::Atomic PhysicsQuantum Physics (quant-ph)
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Tuning nodal line semimetals in trilayered systems

2018

We investigate two-dimensional trilayered quantum systems with multi-orbital conduction bands by focusing on the role played by the layer degree of freedom in setting the character of nodal line semimetals. The layer index can label the electronic states where the electrons reside in the unit cell and can enforce symmetry constraints in the electronic structure by protecting bands crossing. We demonstrate that both the atomic spin-orbit coupling and the removal of local orbital degeneracy can lead to different types of electronic transitions with nodal lines that undergo a changeover from a loop structure enclosing the center of the Brillouin zone to pockets winding around multiple high sym…

PhysicsCondensed matter physicsCondensed Matter - Mesoscale and Nanoscale PhysicsFermi levelGeneral Physics and AstronomyFOS: Physical sciences02 engineering and technologyElectronElectronic structureInvariant (physics)021001 nanoscience & nanotechnology01 natural sciencesBrillouin zonesymbols.namesakeAtomic electron transition0103 physical sciencesMesoscale and Nanoscale Physics (cond-mat.mes-hall)symbolsGeneral Materials SciencePhysical and Theoretical Chemistry010306 general physics0210 nano-technologyQuantumEigenvalues and eigenvectors
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Cavity QED with a trapped ion in a leaky cavity

2002

The dynamics of the interaction of a quantized cavity field and the vibronic degrees of freedom of a trapped ion is studied under realistic conditions by including cavity losses, spontaneous electronic transitions, and atomic nonlinearities. As long as spontaneous electronic transitions are negligible, analytical results are derived for describing the interaction of the trapped ion and the damped cavity field in the secular approximation. Under more general conditions, when the secular approximation breaks down and spontaneous emission effects become important, the dynamics of the system is studied by quantum-trajectory methods. As an example we demonstrate that, by exploiting the nonlinear…

PhysicsQuantum decoherenceField (physics)Atomic electron transitionDegrees of freedom (physics and chemistry)Spontaneous emissionQuantum PhysicsTrappingAtomic physicsAtomic and Molecular Physics and OpticsIonFock spacePhysical Review A
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Emergence of Coherence through Variation of Intermolecular Distances in a Series of Molecular Dimers

2015

Quantum coherences between electronically excited molecules are a signature of entanglement and play an important role for energy transport in molecular assemblies. Here we monitor and analyze for a homologous series of molecular dimers embedded in a solid host the emergence of coherence with decreasing intermolecular distance by single-molecule spectroscopy and quantum chemistry. Coherent signatures appear as an enhancement of the purely electronic transitions in the dimers which is reflected by changes of fluorescence spectra and lifetimes. Effects that destroy the coherence are the coupling to the surroundings and to vibrational excitations. Complementary information is provided by excit…

PhysicsVibronic couplingAtomic electron transitionExcited stateIntermolecular forceGeneral Materials ScienceQuantum entanglementPhysical and Theoretical ChemistryAtomic physicsSpectroscopyMolecular physicsQuantum chemistryCoherence (physics)The Journal of Physical Chemistry Letters
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Disentangling size effects and spectral inhomogeneity in carbon nanodots by ultrafast dynamical hole-burning.

2018

Carbon nanodots (CDs) are a novel family of nanomaterials exhibiting unique optical properties. In particular, their bright and tunable fluorescence redefines the paradigm of carbon as a "black" material and is considered very appealing for many applications. While the field keeps growing, understanding CDs fundamental properties and relating them to their variable structures becomes more and more critical. Two crucial problems concern the effect of size on the electronic structure of CDs, and to what extent their optical properties are influenced by structural disorder. Furthermore, it remains largely unclear whether traditional concepts borrowed from the photo-physics of semiconductor qua…

Potential wellMaterials scienceField (physics)530 Physicschemistry.chemical_element02 engineering and technologyElectronic structure010402 general chemistry021001 nanoscience & nanotechnologyCondensed Matter::Mesoscopic Systems and Quantum Hall Effect620 Engineeringcarbon nanodots fluorescent nanomaterials pump probe carbon materials01 natural sciences0104 chemical sciencesNanomaterialsCondensed Matter::Materials SciencechemistryChemical physicsAtomic electron transitionFemtosecond540 ChemistryGeneral Materials Science0210 nano-technologyCarbonUltrashort pulseNanoscale
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Time-resolved luminescence and absorption in CdWO4

1998

Abstract The luminescence and short-lived absorption are studied in CdWO 4 single crystals under pulsed laser beam as well as pulsed electron beam excitation. The luminescence spectrum and decay kinetics for CdWO 4 powder are studied. The short-lived absorption in single crystals arises from electron transitions from the luminescence center excited state to the conduction band. From luminescence and short-lived absorption spectra the energy depths of luminescence center excited and ground states are estimated.

RadiationOptically stimulated luminescenceAbsorption spectroscopyCondensed Matter::OtherChemistryPhysics::OpticsElectronLaserlaw.inventionCondensed Matter::Materials SciencelawAtomic electron transitionExcited statePhysics::Atomic and Molecular ClustersAtomic physicsLuminescenceAbsorption (electromagnetic radiation)InstrumentationRadiation Measurements
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Solvatochromism Unravels the Emission Mechanism of Carbon Nanodots

2016

High quantum yield, photoluminescence tunability, and sensitivity to the environment are hallmarks that make carbon nanodots interesting for fundamental research and applications. Yet, the underlying electronic transitions behind their bright photoluminescence are strongly debated. Despite carbon-dot interactions with their environment should provide valuable insight into the emitting transitions, they have hardly been studied. Here, we investigate these interactions in a wide range of solvents to elucidate the nature of the electronic transitions. We find remarkable and systematic dependence of the emission energy and kinetics on the characteristics of the solvent, with strong response of …

Range (particle radiation)PhotoluminescenceChemistrySettore FIS/01 - Fisica SperimentaleSolvatochromismQuantum yield02 engineering and technologyElectron010402 general chemistry021001 nanoscience & nanotechnologyPhotochemistryCondensed Matter::Mesoscopic Systems and Quantum Hall Effect01 natural sciencesFluorescence0104 chemical sciencesCondensed Matter::Materials ScienceChemical physicsAtomic electron transitionGeneral Materials ScienceSpontaneous emissionCarbon dots photoluminescence nanomaterialsPhysical and Theoretical Chemistry0210 nano-technologyThe Journal of Physical Chemistry Letters
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Electronic and vibrational signatures of the Au102p-MBA44 cluster

2011

Optical absorption of a gold nanocluster of 102 Au atoms protected by 44 para-mercaptobenzoic acid (p-MBA) ligands is measured in the range of 0.05-6.2 eV (mid-IR to UV) by a combination of several techniques for purified samples in solid and solution phases. The results are compared to calculations for a model cluster Au(102)(SMe)(44) based on the time-dependent density functional theory in the linear-response regime and using the known structure of Au(102)(p-MBA)(44). The measured and calculated molar absorption coefficients in the NIR-vis region are comparable, within a factor of 2, in the absolute scale. Several characteristic features are observed in the absorption in the range of 1.5-…

Spectroscopy Near-Infraredta114ChemistryLigandNear-infrared spectroscopyAnalytical chemistryGeneral ChemistryLigandsBiochemistryCatalysisMetalColloid and Surface ChemistryAtomic electron transitionvisual_artvisual_art.visual_art_mediumCluster (physics)Density functional theoryGoldAbsorption (chemistry)Spectroscopyta116Journal of the American Chemical Society
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