Search results for "polaron"
showing 10 items of 79 documents
Transient absorption and luminescence of LiNbO3 and KNbO3
2001
Abstract The results of time-resolved optical absorption spectra in congruent and stoichiometric LiNbO3 as well as KNbO3 crystals are reported. The role of different polaron types in transient absoiption and luminescence spectra and decay kinetics are discussed.
Defect induced room temperature ferromagnetism in high quality Co-doped ZnO bulk samples
2021
The nature of the often reported room temperature ferromagnetism in transition metal doped oxides is still a matter of huge debate. Herein we report on room temperature ferromagnetism in high quality Co-doped ZnO (Zn1-xCoxO) bulk samples synthesized via standard solid-state reaction route. Reference paramagnetic Co-doped ZnO samples with low level of structural defects are subjected to heat treatments in a reductive atmosphere in order to introduce defects in the samples in a controlled way. A detailed structural analysis is carried out in order to characterize the induced defects and their concentration. The magnetometry revealed the coexistence of a paramagnetic and a ferromagnetic phase …
Relaxation of electronic excitations in LiNbO3crystals
2001
Transient absorption both in stoichiometric and Mg doped congruent LiNbO was observed after pulsed electron beam excitation. The luminescence spectra and decay kinetics in these materials show different excitonic relaxation possibilities. The dependence on sample stoichiometry is also discussed.
Structural and Electric Properties of Sodium Lithium Niobate Ceramic Solid Solution Li0.08Na0.92NbO3
2011
A lead-free solid solution Li0.08Na0.92NbO3 was prepared by a two-stage hot-pressing technology. The structure and morphology of Li0.08Na0.92NbO3 were characterised by X-ray diffraction (XRD) and scanning electron microscopy (SEM). The studies of electric conductivity were performed depending on temperature and frequency of electric measuring field on heating and cooling processes. These measurements revealed that the a.c. conductivity changed with the frequency according to the formula: σ(ω)=σ dc +Aω n where n < 1. These results were discussed considering the conduction mechanism as a type of polaron hopping.
Spectroscopic and theoretical study of the molecular and electronic structures of a terthiophene-based quinodimethane.
2004
The UV/Vis, infrared absorption, and Raman scattering spectra of 3',4'-dibutyl-5,5"-bis(dicyanomethylene)-5,5"-dihydro-2,2':5',2"-terthiophene have been analyzed with the aid of density functional theory calculations. The compound exhibits a quinoid structure in its ground electronic state and presents an intramolecular charge transfer from the terthiophene moiety to the C(CN)2 groups. The molecular system therefore consists of an electron-deficient terthiophene backbone end-capped with electron-rich C(CN)2 groups. The molecule is characterized by a strong absorption in the red, due to the HOMO-->LUMO pi-pi* electronic transition of the terthiophene backbone that shifts hypsochromically on …
Theoretical simulations of the radiation-induced defect processes in insulating materials
1994
Abstract The results of two basic kinds of computer simulations of radiation-induced processes in insulating materials, one based on quantum-mechanical and pair-potential (atomistic) approaches, and the other a phenomenological theory of diffusion-controlled reactions, are presented. It is shown that, by combining different techniques (atom-atom potentials and semi-empirical quantum chemical methods) the optimized geometry and the electronic structure of a family of hole centres in crystalline corundum (α-Al2O3) could be found. Their energetics are analyzed; V2−, V−V−Mg hole centres all have a common basic element, namely the diatomic molecule O23−, which is responsible for their similar ab…
Theoretical and experimental study of primary radiation defects in KNbO3 perovskite crystals
2000
Abstract The results of large-scale computer simulations of point defects – F-type electron centers and hole polarons bound to a potassium vacancy – in perovskite KNbO3 crystals are presented. One-site polarons and two-site (molecular) polarons are expected to coexist, both are characterized by close absorption energies around 1 eV. The transient absorption spectra and decay kinetics observed after ns-pulsed electron beam irradiation have been measured for different KNbO3 crystals. The relaxation kinetics of the optical density vary considerably for different impurity concentrations and sample stoichiometries. Experimental data are discussed in the light of the presented calculations.
Relaxation of electronic excitations in strontium titanate
2002
The transient absorption spectra and kinetics were studied for undoped, lead doped and high purity SrTiO 3 single crystals. The pulsed electron beam induced transient absorption is studied in all crystals. The strong absorption at 0.8 v eV was observed only in high purity SrTiO 3 . This absorption is suggested to arise from intrinsic electron polaron. The bound electron polarons are likely responsible for absorption band at 1.4 v eV. The main luminescence band under excitation pulse is observed at 2.75 v eV. The luminescence decay is faster than that of transient absorption.
Pulsed electron beam excited transient absorption in SrTiO3
2002
Abstract Transient absorption (TA) spectra and optical density relaxation kinetics in SrTiO3 (STO), STO–Nb and STO–V were studied. The electron polaron free or bound at intrinsic defect is suggested to be responsible for the TA band at ∼1.4 eV observed in STO. The band peaking below 0.75 eV in STO–Nb is proposed to be from Nb4+. The electron center V3+ or electron polaron bound in the vicinity of V4+ is responsible for the absorption band at 1.0 eV in STO–V. The absorption from hole polarons is suggested to be in the range 1.8–2.3 eV. It is shown that TA in pure STO at room temperature decays due to electron–hole polaron recombination.
Experimental and theoretical studies of polaron optical properties in KNbO3 perovskite
2004
Time-resolved absorption and luminescence spectra have been measured in KNbO3 perovskite crystals after pulsed band-gap excitation by 200 fs laser pulses and 10 ns electron pulses. Quantum chemical calculations using the large unit cell periodic model support the interpretation of the observed transient absorption bands at 0.8 and 1.1 eV as the self-trapped electron polarons and bound hole polarons, respectively. The activation energy for the 2.2 eV green luminescence quenching is 0.05 eV. We suggest that the short lifetime (,15 ns) of the luminescence at RT is caused by the radiative recombination of nearest electron and hole polarons. q 2003 Elsevier Ltd. All rights reserved.