Search results for "impur"
showing 10 items of 349 documents
The Electronic Structure of Hexagonal BaCoO3
1999
Abstract TB–LMTO–ASA band structure calculations within the local spin density approximation have been performed to explain the magnetic and transport properties of BaCoO3. The calculations predict a magnetic and metallic ground state as energetically favored. BaCoO3 shows no long-range magnetic ordering, however, and only poor conductivity. The magnetic energy is low and the compound shows glassy susceptibility behavior at low temperatures. From the band structure we find Mott–Hubbard localization to be unlikely, and instead propose Anderson localization as a possible origin of the observed behavior. Calculations on slightly distorted structures exclude the possibility of a Peierls distort…
Computed positron lifetimes in vacancies and vacancy-iron clusters in gold
1983
Abstract Annihilation characteristics are calculated for positrons trapped in clean and impurity decorated vacancy clusters in Au. The positron lifetime depends strongly on the structure of the clusters. In a strongly relaxed vacancy cluster, the lifetime can become smaller than the lifetime in a single vacancy. The substitution of some neighbour atoms of a vacancy cluster by Fe atoms has only a minor effect on the positron lifetimes.
Effect of Zr4+Doping on the Electrical Properties of BaTiO3Ceramics
2011
The BaZrxTi1-xO3 for 0⩽x⩽15 ceramics were prepared by a conventional solid state reaction method and were determined by an X-ray diffraction (XRD) and scanning electron microscopy (SEM) for crystallographic, surface morphological and compositional studies. A single phase with perovskite structure was identified in the samples at room temperature. No significant impurities were detected in an EDS spectrum and the samples are in good stoichiometric ratio. The temperature dependence of electric conductivity was evaluated in the temperature range from 300 to 550 K for a selected frequency by a HP4284 LCR meter. The activation energy was calculated from the Arrhenius plots.
Dipolar and orientational glass formation in two-dimensional films of CO mixtures
2002
Heat-capacity and dielectric measurements have been performed to study orientational and dipolar order and disorder phenomena in submonolayer films of CO and binary mixtures of CO physisorbed on graphite and boron nitride (BN). With both methods transitions to quadrupolar and dipolar ordered low-temperature phases have been found for pure CO. Calorimetric measurements revealed that the dipolar transition of CO on graphite belongs to the universality class of the two-dimensional (2D) Ising model. It will be shown that in dilute mixtures of CO with CH 4 molecules a dramatic suppression of this phase transition occurs. This effect turned out to be much stronger than that previously observed in…
Dressed emitters as impurities
2021
Dressed states forming when quantum emitters or atoms couple to a photonic bath underpin a number of phenomena and applications, in particular dispersive effective interactions occurring within photonic bandgaps. Here, we present a compact formulation of the resolvent-based theory for calculating atom-photon dressed states built on the idea that the atom behaves as an effective impurity. This establishes an explicit connection with the standard impurity problem in condensed matter. Moreover, it allows us to formulate and settle in a model-independent context a number of properties previously known only for specific models or not entirely formalized. The framework is next extended to the cas…
Ca impurity in small mixed He-4-He-3 clusters
2009
The structure of small mixed helium clusters doped with one calcium atom has been determined within the diffusion Monte Carlo framework. The results show that the calcium atom sits at the He-4-He-3 interface. This is in agreement with previous studies, both experimental and theoretical, performed for large clusters. A comparison between the results obtained for the largest cluster we have considered for each isotope shows a clear tendency of the Ca atom to reside in a deep dimple at the surface of the cluster for He-4 clusters, and to become fully solvated for He-3 clusters. We have calculated the absorption spectrum of Ca around the 4s4p <- 4s(2) transition and have found that it is bluesh…
The growth of oxide platelets on nickel in pure oxygen. II. Surface analyses and growth mechanism
1993
The structural properties of NiO platelets emerging from a primary oxide layer by oxidation of pretreated nickels in pure oxygen between 650 and 800° C have been investigated in relation with the initial metallic layers and the primary oxide. Surface composition and segregation of impurities were also studied by X-ray photoelectron spectroscopy and Auger electron spectroscopy. Textural properties and structural orientation of both the primary oxide layer and the platelets were analyzed by X-ray diffraction and transmission electron microscopy. Platelets grew along {111} planes, leading to elliptical or semicircular bicrystals. The driving force for the present type of growth originates from…
Atomic Layer Deposition of Spinel Lithium Manganese Oxide by Film-Body-Controlled Lithium Incorporation for Thin-Film Lithium-Ion Batteries
2013
Lithium manganese oxide spinels are promising candidate materials for thin-film lithium-ion batteries owing to their high voltage, high specific capacity for storage of electrochemical energy, and minimal structural changes during battery operation. Atomic layer deposition (ALD) offers many benefits for preparing all-solid-state thin-film batteries, including excellent conformity and thickness control of the films. Yet, the number of available lithium-containing electrode materials obtained by ALD is limited. In this article, we demonstrate the ALD of lithium manganese oxide, LixMn2O4, from Mn(thd)3, Li(thd), and ozone. Films were polycrystalline in their as-deposited state and contained le…
Overview of the JET results
2015
Since the installation of an ITER-like wall, the JET programme has focused on the consolidation of ITER design choices and the preparation for ITER operation, with a specific emphasis given to the bulk tungsten melt experiment, which has been crucial for the final decision on the material choice for the day-one tungsten divertor in ITER. Integrated scenarios have been progressed with the re-establishment of long-pulse, high-confinement H-modes by optimizing the magnetic configuration and the use of ICRH to avoid tungsten impurity accumulation. Stationary discharges with detached divertor conditions and small edge localized modes have been demonstrated by nitrogen seeding. The differences in…
Experimental evidence of E’_gamma centers generation from oxygen vacancies in a-SiO2
2007
Abstract We report on the thermal treatment effects in a γ-ray irradiated oxygen deficient amorphous silicon dioxide (a-SiO2) containing Al impurities. We observed that by thermal treatments the intensity of the 7.6 eV optical absorption band, associated to an oxygen deficient center, and the EPR signal amplitude of irradiation induced [AlO4]0 centers gradually decrease. During these thermal treatments, the E γ ′ centers concentration is found to increase in a correlated way to the decrease of the 7.6 eV absorption amplitude. These results are interpreted assuming an hole-transfer process from the [AlO4]0 centers to the diamagnetic oxygen vacancies, resulting in the generation of E γ ′ cent…