Materials Literature
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Density functional theory (DFT) with a tailored Hartree-Fock hybrid functional, which can overcome the band gap problem arising in conventional DFT and gives a valence band width comparable with experiment, is applied to determine formation energies and electronic structures of intrinsic defects in cubic silicon carbi…
Objective: To evaluate the performance of preliminary phytochemical, antioxidant and antimicrobial activities of Dracaena cinnabari Balf.f. (Agavaceae) (D. cinnabari) resin, collected from Socotra Island (Yemen). Methods: The powdered stem resin is extracted with different solvents by using Soxhlet apparatus and evalu…
Traditional neutron tomography allows to reconstruct the attenuation cross section, a measure for the material distribution, at high spatial resolution and non-destructively. However, it does not state anything about the ordering structure of the atoms inside this material. Extending the setup with a second neutron im…
Comparative studies are presented of iron oxide nanoparticles in the 7–15 nm average diameter range ball milled in hexane in the presence of oleic acid. Transmission electron microscopy identified spherical particles of decreasing size as milling time and/or surfactant concentration increased. Micromagnetic characteri…
The photo-induced transformations of HXeSH and HXeH under the action of IR and visible light have been studied using FTIR spectroscopy. The xenon hydrides were produced by the X-ray induced decomposition of H2S and its isotopomers in a solid xenon matrix at 7.5 K followed by thermal annealing at the temperatures up to…
BACKGROUND: Small non-coding RNAs (ncRNAs) are important regulators of gene expression in eukaryotes. Previously, only microRNAs (miRNAs) and piRNAs have been identified in the silkworm, Bombyx mori. Furthermore, only ncRNAs (50-500nt) of intermediate size have been systematically identified in the silkworm. RESULTS:…
The evolution of flow units associated with the flow “defects” in metallic glass is characterized by monitoring the metallic glassy density change upon isothermal annealing far below their glass transition temperature. A meaningful function for the density variation with the concentration of flow units is obtained for…
Argon Gas Cluster-Ion Beam sources are likely to become widely used on x-ray photoelectron spectroscopy and secondary ion mass spectrometry instruments in the next few years. At typical energies used for sputter depth profiling the average argon atom in the cluster has a kinetic energy comparable with the sputter thre…
Bifurcated halogen bonds constructed from N-oxides and complementary halogen-bond donors provide the basis for a synthetic strategy for the deliberate assembly of molecular polygons in the solid state. The donor- and acceptor sites were located on different molecular components and a co-crystallization approach furnis…
In this study, the in vitro and in vivo functions of the only two identified protein phosphatases, Saci-PTP and Saci-PP2A, in the crenarchaeal model organism Sulfolobus acidocaldarius were investigated. Biochemical characterization revealed that Saci-PTP is a dual-specific phosphatase (against pSer/pThr and pTyr), whe…
In this study, the influence of the morphology on the electrocatalytic activity of nickel oxide nanostructures toward methanol oxidation is investigated. Two nanostructures were utilized: nanoparticles and nanofibers. NiO nanofibers have been synthesized by using the electrospinning technique. Briefly, electrospun nan…
Various studies show that employment of nitrogen coatings on certain biomaterials can noticeably increase the degree of biocompatibility (particularly for vascular repair) [1]. Chemical and laser ablation surface modification techniques are used for introduction or enrichment of nitrogen. However alteration of bulk ma…
The precessional magnetization dynamics of GaMnAs thin films are characterized by broadband network analyzer ferromagnetic resonance (FMR) in a coplanar geometry at cryogenic temperatures. The FMR frequencies are characterized as function of in-plane field angle and field amplitude. Using an extended Kittel model of t…
The purpose of the present study was to investigate the microstructure and microhardness of novel Ti7CuXSn alloys. Ti7CuXSn alloys with x = 0, 1, 2·5 and 5 wt- were synthesised using a well developed arc melting and casting method. The microstructure was analysed by means of optical microscopy, SEM and X-ray diffracti…
This work reports on the phase behavior of hard spherical caps in the interval of particle shapes delimited by the hard platelet and hemispherical cap models. These very simple model colloidal particles display a remarkably complex phase behavior featuring a competition between isotropic-nematic phase separation and c…
Effective mechanical properties of nanocomposites reinforced with multiwalled carbon nanotubes (MWCNTs) have been determined using Finite Element Analysis (FEA). The effects of several parameters on nanocomposite effective mechanical properties are investigated. First, FEA models are created consisting of MWCNTs with…
Using fast off-lattice Monte Carlo simulations with experimentally accessible fluctuations, we reported the first systematic study unambiguously quantifying the shift of the order-disorder transition (ODT) χ* of symmetric diblock copolymers from the mean-field prediction \documentclass[12pt]{minimal}\begin{document}$\…
Products of the isothermal compressibility, κT, and the surface tension, σ, that have been discussed in the literature for liquids in general are shown for over 60 molten salts. The applications of the scaled particle theory of Mayer and the simplified corresponding states correlation of Harada et al. [Ind. Eng. Chem.…
Germanane (GeH) and silicane (SiH) are the fully hydrogenated forms of germanene and silicene, the Ge- and Si-analogues of graphene. Here we use density-functional theory calculations to probe the properties of GeH and SiH sheets and their dependence on applied uni-axial compression. We find that GeH polymorphs with d…
In this work, the ternary system of potassium-sodium niobate has been designed to enhance the piezoelectric properties without sacrificing the Curie temperature greatly, and (0.97 − x)K0.48Na0.52NbO3-0.03Bi0.5(Na0.7K0.2Li0.1)0.5ZrO3-xB0.5Na0.5TiO3 ceramics have been prepared by the conventional solid-state method. The…