Search results for "purity"
showing 10 items of 356 documents
MOKE magnetometry as a probe of surface magnetic impurities in electropolymerized magnetic thin films of the Prussian blue analogue Fe3[Cr(CN)6]2·15 …
2013
A magneto-optical Kerr effect (MOKE) study has been performed on electrodeposited thin films of the Prussian blue analogue Fe3[Cr(CN)6]2·15H2O (1). This study reveals the onset of hysteretic magnetic signals at temperatures above 60 K, in contrast with magnetic susceptibility measurements which indicate a Curie temperature of 23 K for this ferromagnetic film. The origin of this discrepancy is due to the presence of amorphous iron oxide particles that accumulate in the surface of the material. This report illustrates the potential of MOKE magnetometry for the detection of surface chemical impurities that remain elusive using bulk magnetic techniques.
Theoretical study of the stabilization of cubic-phaseZrO2by impurities
1994
We have performed a thermodynamical analysis of the phase diagrams for ${\mathrm{ZrO}}_{2}$-CaO and ${\mathrm{ZrO}}_{2}$-MgO solid solutions which has demonstrated that differential heats of mixing are important parameters determining the stabilization of the cubic phase of ${\mathrm{ZrO}}_{2}$ by impurities. It is shown that the differential heats of mixing in the cubic phase of these systems should be lower than in the tetragonal phase. To understand this effect we have studied the electronic and geometrical structures of the pure and doped ${\mathrm{ZrO}}_{2}$ crystals. Three computational techniques were employed: the ab initio Hartree-Fock pseudopotential method is used to study the at…
Hybrid-Functional Calculations on the Incorporation of Na and K Impurities into the CuInSe 2 and CuIn 5 Se 8 Solar-Cell Materials
2015
International audience; We have studied the energetics, atomic, and electronic structure of Na and K point defects, as well as the (Na-Na), (K-K), and (Na-K) dumbbells in CuInSe2 and CuIn5Se8 solar cell materials by hybrid functional calculations. We found that although Na and K behaves somewhat similar; there is a qualitative difference between the inclusion of Na and K impurities. Namely, Na will be mostly incorporated into CuInSe2 and CuIn5Se8 either as an interstitial defect coordinated by cations, or two Na impurities will form (Na-Na) dumbbells in the Cu sublattice. In contrast to Na, K impurities are less likely to form interstitial defects. Instead, it is more preferable to accommod…
Determination of local defect density in diamond by double electron-electron resonance
2021
Magnetic impurities in diamond influence the relaxation properties and thus limit the sensitivity of magnetic, electric, strain, and temperature sensors based on nitrogen-vacancy color centers. Diamond samples may exhibit significant spatial variations in the impurity concentrations hindering the quantitative analysis of relaxation pathways. Here, we present a local measurement technique which can be used to determine the concentration of various species of defects by utilizing double electron-electron resonance. This method will help to improve the understanding of the physics underlying spin relaxation and guide the development of diamond samples, as well as offering protocols for optimiz…
Quantum chemical calculations of KTN solid solutions
1998
Abstract The results of semi-empirical calculations for perovskite KNbxTa1−xO3 (KTN) solid solutions are presented for x = 0.04, 0.11, 0.89, and 0.96. Quantum chemical method of the Intermediate Neglect of the Differential Overlap (INDO) was combined with 135- and 320-atom supercells. Analysis of the optimised atomic and electronic structure has clearly demonstrated that several nearest Nb atoms substituting for Ta in KTaO3 — unlike Ta impurities in KNbO3 — reveal the self-ordering effect, which probably triggers the ferroelectricity observed in KTN.
Nonequilibrium critical scaling in quantum thermodynamics
2016
The emerging field of quantum thermodynamics is contributing important results and insights into archetypal many-body problems, including quantum phase transitions. Still, the question whether out-of-equilibrium quantities, such as fluctuations of work, exhibit critical scaling after a sudden quench in a closed system has remained elusive. Here, we take a novel approach to the problem by studying a quench across an impurity quantum critical point. By performing density matrix renormalization group computations on the two-impurity Kondo model, we are able to establish that the irreversible work produced in a quench exhibits finite-size scaling at quantum criticality. This scaling faithfully …
UV-light induced luminescence processes in Al2O3 bulk and nanosize powders
2010
Abstract UV-light induced photoluminescence (PL) and thermoluminescence (TL) have been studied in the alumina (Al2O3) bulk and nanosize powders. It has been found that luminescence properties of the studied alumina powders are determined mainly by presence of the uncontrolled impurities of titanium, iron and chromium. Despite the general similarity of PL characterized by two main emission band around 400 and 750 nm a number of differences has been observed in relative yield and position of the emission bands as well as in the excitation spectrum of the short wavelength band. Essential differences have been observed also in the intensity of the TL signal, TL curves and TL emission spectra re…
Displacement Defect Formation in Complex Oxide Crystals under Irradiation
2000
The work is devoted to an analysis of formation processes of the radiation displacement defects (RDDs) and colour centres (CCs) in complex oxide crystals under irradiation. The calculation results on: the displacement process simulation as well as an analysis of the RDD and CC accumulation kinetics are presented. New experimental results on additional absorption spectra induced by neutron irradiation of LiNbO(3) (LNO) crystals doped with Fe and Cr and YAlO(3) (YAP) crystals doped with Nd and Er as well are presented. Dose dependencies of the additional absorption are compared and their peculiarities are discussed. The obtained results confirm that CCs causing the irradiation induced absorpt…
Luminescence and transient absorption in ZnWO4 and ZnWO4–Fe crystals
2001
Abstract The transient absorption spectra and relaxation kinetics under pulse electron beam excitation in ZnWO 4 and ZnWO 4 –Fe, as well as luminescence spectra and decay kinetics, were studied. It is shown that a fraction of transient absorption is due to luminescence center excited state. The energy transfer from intrinsic excitations to the defect or impurity states is not efficient. The role of Fe-impurities in the decay process is discussed.
Photo- and thermostimulated processes in α-Al2O3
1995
Abstract We reported on the recombination processes determined by the release of electrons from defects connected with the dosimetric 430 K thermostimulated luminescence (TSL) peak as well as with the 260 K TSL peak. These TSL peaks appear in thermochemically reduced α-Al 2 O 3 crystals containing hydrogen and emission of these TSL peaks corresponds to luminescence of the F-center. The X-ray exposure or UV excitation in the absorption band of F-centers at 6.0 eV of reduced α-Al 2 O 3 crystals doped with acceptor impurities results in the appearance of a broad anisotropic complex absorption band in the spectral region 2.5–3.5 eV and in the appearance of a predominant TSL peak at 430 K. Above…