Materials Literature
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New alkali borosulfates were obtained by precipitation from oleum, solid-state reactions, or thermal decomposition. The crystal structures were characterized with single-crystal data. They are all based on corner-linked BO4 and SO4 tetrahedra with varying coordination of the alkali cations. According to the ratio of B…
Here we introduce the concept of 'optimal particles' for strong interactions with electromagnetic fields. We assume that a particle occupies a given electrically small volume in space and study the required optimal relations between the particle polarizabilities. In these optimal particles, the inclusion shape and mat…
Microneedles are a relatively simple, minimally invasive and painless approach to deliver drugs across the skin. However, there remain limitations with this approach because of the materials most commonly utilized for such systems. Silk protein, with tunable and biocompatibility properties, is a useful biomaterial to…
SnS nanoparticles were synthesised by the precipitation method using SnCl2.2H2O and Na2S.xH2O and the nanoparticles were characterised by X-ray diffraction (XRD) and Fourier transform infrared (FTIR) analysis. From the particles’ XRD pattern, a strong peak at 2θ = 31.5˚ was observed, which confirms the Herzenbergite o…
ABSTRACT Polymerized soybean oils of different molecular weights were used as plasticizers in NR/SBR compositions. The oils of different molecular weights and viscosities were synthesized by cationic polymerization using a proprietary technology. Because vegetable oils have double bonds, they are not only viscosity de…
We report a computational study on the photochemistry of the prototypical aromatic Schiff base salicylideneaniline in the gas phase using static electronic structure calculations (TDDFT, OM2/MRCI) and surface-hopping dynamics simulations (OM2/MRCI). Upon photoexcitation of the most stable cis-enol tautomer into the br…
Immunomodulation by nanoparticles, especially as related to the biochemical properties of these unique materials, has scarcely been explored. In an in vitro model of human immunity, we demonstrate two catalytic nanoparticles, TiO₂ (oxidant) and CeO₂ (antioxidant), have nearly opposite effects on human dendritic cells…
The study of conducting polymeric membranes is decisive in some areas, as in fuel cells and electrodialysis. This work aims the study of membranes using conventional and conductive polymers blends. Two types of polyurethane were used as conventional polymers, commercial thermoplastic polyurethane and polyurethane synt…
We study the transient behavior of a model fluid composed by soft repulsive spheres subjected to a planar uniform shear. To this aim, we use a dynamical non-equilibrium molecular dynamics method originally developed by Ciccotti and Jacucci [Phys. Rev. Lett. 35, 789 (1975)] and recently applied to the study of the tran…
We present a study of free carrier photogeneration and multicarrier bound states, such as biexcitons and trions (charged excitons), in semiconducting single-walled carbon nanotubes. Pump-and-probe measurements performed with fs pulses reveal the effects of strong Coulomb interactions between carriers on their dynamics…
We report the first synthesis of colloidal CuInTe2, CuInTe2-xSex gradient alloyed quantum dots (QDs) through a simple hot injection method. We confirmed the composition of synthesized QDs to cationic rich phase of CuIn1.5Te2.5 and Cu0.23In0.36Te0.19Se0.22 with XPS and ICP analysis, and we have also found that the grad…
The production of high-quality phosphors for white-emitting applications is an important goal for the settlement of light-emitting diodes (LEDs) in the market and households. Single phosphors directly yielding white emission are advantageous in comparison to a mixture of individual red, green, and blue phosphors as th…
Abstract Solid‐oxide fuel cells are an attractive energy conversion technology for clean electric power production. To render them more affordable, discovery of new cathode materials with high reactivity to oxygen reduction reaction (ORR) at temperatures below 700 °C is needed. Recent studies have demonstrated that La…
The application of PhotoEmission Electron Microscopy (PEEM) and Low Energy Electron Microscopy (LEEM) techniques to the study of the electronic and chemical structures of ferroelectric materials is reviewed. Electron optics in both techniques gives spatial resolution of a few tens of nanometres. PEEM images photoelect…
We present calculations of free energy barriers and diffusivities as functions of temperature for the diffusion of hydrogen in bcc-Fe. This is a fully quantum mechanical approach since the total energy landscape is computed using a new self consistent, transferable tight binding model for interstitial impurities in ma…
Domain structures of 320 nm thin epitaxial films of ferroelectric PbTiO3 grown by metal-organic chemical vapor deposition technique in identical conditions on SmScO3 and TbScO3 perovskite substrates have been investigated by Raman spectroscopy and piezoresponse force microscopy techniques. Phonon frequency shifts and…
The effective piezoelectric coefficients of twin walls in tetragonal ferroelectric are calculated in the framework of decoupling approximation and Landau-Ginzburg-Devonshire theory allowing for polarization gradient terms, electrostriction and flexoelectric coupling. Using an example of piezoelectric response of a1-a2…
Layered double hydroxide nanoparticles (LDHNPs) with exceptionally small particle sizes are synthesized using a tripodal ligand of tris(hydroxymethyl)aminomethane (THAM). For example, a LDHNP with the average size of 9.7 nm (denoted as LDH(10 nm), containing CO 3 2– in the interlayer), can be synthesized using a 2.0 M…
Abstract The thrust to develop eco-friendly procedures for the production of nanoparticles arises from the extremely recent nanotechnology research. Extracellular biosynthesis of gold nanoparticles was achieved by an easy biological procedure using Klebsiella pneumoniae as the reducing agent. After exposing the gold i…
Birefringent crystals (BFC) have been extensively used in imaging spectrometer, laser devices, and optical components. Seeking new BFC is of important for both fundamental research and industrial application. Employed first-principles density functional theory (DFT), we found that LaOBiS2 (space group P4/nmm), the par…