Materials Literature
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In this set of lecture notes we review the mode-coupling theory of the glass transition from several perspectives. First, we derive mode-coupling equations for the description of density fluctuations from microscopic considerations with the use the Mori–Zwanzig projection operator technique. We also derive schematic m…
The original regime of operation for flat superlenses formed by electromagnetic crystals is proposed. This regime does not involve negative refraction and amplification of evanescent waves in contrast to the perfect lenses formed by left-handed media. The subwavelength spatial spectrum of a source is canalized by the…
The structural, dynamical, and thermodynamic properties of diamond, graphite and layered derivatives (graphene, rhombohedral graphite) are computed using a combination of density-functional theory total-energy calculations and density-functional perturbation theory lattice dynamics in the generalized gradient approxim…
Abstract Dehydrated, hydrated and superhydrated NaA zeolites have been studied by impedance spectroscopy with scanning frequency from 1 Hz to 1 MHz at high pressure up to 4.5 GPa. A considerable anomalous increase in electrical conductivity in the range of 0.5–1.1 GPa was observed in superhydrated NaA zeolite containi…
International audience
A thermodynamic theory of compositionally graded materials is developed, based on a term in the Landau formula for free energy of the form γPgradc, where P, c, and γ stand for the polarization, the atomic concentration, and a phenomenological coefficient, respectively. The consequence of this term is the following: (1…
Abstract A new system of BNT‐based multi‐component lead‐free piezoelectric ceramics, [Bi 1– z (Na 1– x – y – z K x Li y )] 0.5 Ba z TiO 3 , was prepared by conventional ceramic technique and the electrical properties of the ceramics were studied. The analysis of X‐ray diffraction shows that all ceramics investigated c…
Recent microwave experiments demonstrate the anapole-moment and magnetoelectric properties in quasi-2D ferrite particles with magnetic-dipolar-wave oscillating spectra. The theory developed in this paper shows that there are the macroscopically quantum topological effects. Quantum coherence for macroscopic systems ref…
The current noise of a voltage biased interacting quantum wire adiabatically connected to metallic leads is computed in presence of an impurity in the wire. We find that in the weak backscattering limit the Fano factor characterizing the ratio between shot noise and backscattering current crucially depends on the nois…
The nearly dispersionless, so-called "optical" vibrational modes observed by inelastic neutron scattering from icosahedral Al-Pd-Mn and Zn-Mg-Y quasicrystals are found to correspond well to modes of a continuum elastic sphere that has the same diameter as the corresponding icosahedral basic units of the quasicrystal.…
Spin Polarized Low Energy Electron Microscopy is used as a spin dependent spectroscopic probe to study the spin dependent specular reflection of a polarized electron beam from two different magnetic thin film systems: Fe/W(110) and Co/W(110). The reflectivity and spin-dependent exchange-scattering asymmetry are studie…
Abstract CuI nanoparticles were fabricated from conventional CuI powders in micrometer size. Acetonitrile was used as a dispersing agent to dissolve CuI powders. With acetonitrile evaporated, poly-2-vinylpyrolidine (PVP) in the solution could effectively restrict CuI particle growth, prevent them from aggregation, and…
The microstructure evolution in pure copper deformed by rolling at liquid nitrogen temperature was determined by using X-ray diffraction peak profile analysis. The crystallite size distribution and defects evolution were determined as a function of different reduction levels (e.g., 67%, 74%, 87%, and 97%). By using th…
In situ high-temperature X-ray diffraction (XRD) data have been collected for silver behenate, CH3(CH2)20COOAg. In the absence of development chemistry silver behenate exhibits four phase transformations when heated from room temperature to 200 °C. Combining XRD and differential scanning calorimetry (DSC) results, the…
The 1H NMR spectra of iron(III) 5-ethynyl-10,15,20-tri(p-tolyl)porphyrin [(ETrTP)Fe(III)X(n)], iron(III) 5-(phenylethynyl)-10,15,20-tri(p-tolyl)porphyrin [(PETrTP)Fe(III)X(n)], iron(III) 5-(phenylbutadiynyl)-10,15,20-tri(p-tolyl)porphyrin [(PBTrTP)Fe(III)X(n)], iron(III) 5,10,15,20-tetra(phenylethynyl)porphyrin [(TPEP…
The physical and thermal properties Of P2O5-Al2O3-BaO-La2O3 glasses were investigated. The effects of glass compositions on the transition temperature, thermal expansion coefficient, density, hardness and refractive index of glasses were studied. The highest hardness of the glasses is 4143.891 MPa and the lowest therm…
The compound {(mu-bpym)[Cu(AsPh3)2]2}(BF4)2 (1) has been prepared and studied in comparison with the triphenylphosphine analogue 2. Qualitatively, the structure of 1 with characteristically distorted copper(I) coordination caused by Ph/bpym/Ph sandwich interactions is similar to that of 2 and is approximately reproduc…
Various MX (M = Cd, Zn, and Mn, X = S and Se) semiconductor quantum dots (QDs) were prepared in zeolite Y. While the QDs are readily expelled from zeolite interior upon exposure of the MX QD-incorporating zeolite Y ([MX]-Y) to the ambient atmosphere due to moisture adsorption, they remain tightly confined within zeoli…
Boron hydrides (BH3, B2H6, B3H7, B4H10, B5H9, and B5H11) and their cations are studied by the coupled cluster CCSD(T) theory, the second-order Mller-Plesset (MP2) perturbation method, and the electron propagator theory in the partial third-order quasi-particle approximation, using the 6-311G(d,p) basis set. The vertic…
The static and dynamic first hyperpolarizabilities for a series of substituted metallabenzene-based nonlinear optical (NLO) chromophores were determined by time-dependent density functional theory (TDDFT). The electronic excitation contributions to the first hyperpolarizability are rationalized in terms of the two-lev…