Materials Literature
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A density functional theory (DFT) study has been conducted in this work to investigate the mechanism of methanol conversion using cold plasmas. All pathways for initial methanol dissociation were analyzed. The feasibility of the production of various products, including hydrogen, carbon monoxide, and ethylene glycol (…
Theory and numerical simulations are used to investigate the concentration fluctuations and the microstructure in dilute sedimenting suspensions of orientable and deformable particles at zero Reynolds number. The case of orientable particles is studied using prolate and oblate spheroids, while viscous droplets in the…
The electromagnetic force from two interfering light beams on isotropic materials is derived for surface relief grating formation processes. The Navier-Stokes equation is solved for the electromagnetic force induced motion inside the ``photoplasticized'' amorphous azopolymer film. The predicted inscription rates and s…
Imidazolium perchlorate has been synthesized and studied over a wide range of temperatures by differential scanning calorimetry, x-ray diffraction, proton magnetic resonance, optical observation, and dielectric spectroscopy. Polymorphic solid-solid phase transitions have been disclosed at 487, 373, and 247 K. The crys…
This paper describes the seed-mediated growth of highly aligned gold nanorods (Au NRs) over large areas directly on a Si(100) surface. The Si(100) surface is NH2-functionalized with (aminopropyl)triethoxysilane (APTES) followed by a DCC-catalyzed surface amidation reaction with acetic acid. After exposure to a gold na…
The purpose of this study was to evaluate the characteristics of a chitosan film cross-linked by a naturally occurring compound, aglycone geniposidic acid (aGSA). This newly developed aGSA-cross-linked chitosan film may be used as an edible film. The chitosan film without cross-linking (fresh) and the glutaraldehyde-c…
Silicone elastomer composites containing multiwalled carbon nanotubes have been irradiated with near-infrared light to study their mechanical actuation response. We show that the speed of the stimulated response is faster than Debye relaxation, instead following a compressed-exponential law. However, the relaxation af…
The two novel compounds, [Mn(tren)]Sb2S4 (1 and 2), were obtained by the reaction of elemental Mn, Sb, and S in aqueous solutions of tren (tren = tris(2-aminoethyl)amine, C6H18N4) after different reaction times. Compound 1 is formed up to a reaction time of 13 d, and an extension of the reaction time leads to the form…
The thermal conductivity of silicon thin films is predicted in the directions parallel and perpendicular to the film surfaces (in-plane and out-of-plane, respectively) using equilibrium molecular dynamics, the Green-Kubo relation, and the Stillinger-Weber interatomic potential. Three different boundary conditions are…
Aqueous reaction mixtures containing citric acid, guanidinium carbonate, and a range of metal cations (Mg2+, Mn2+, Fe2+, Co2+, Ni2+, and Zn2+) at room temperature give crystalline products of composition [C(NH2)3]8[(M(II))4(cit)4].8H2O (cit = citrate). In all cases, the crystals are suitable for single-crystal X-ray d…
The catalytic properties of transition metal particles often depend crucially on their chemical environment, but so far, little is known about how the effects of the environment vary with particle size, especially for clusters consisting of only a few atoms. To gain insight into this topic, we have studied the oxygen…
Under conditions of acidic pH and elevated temperature, insulin partially unfolds and aggregates into highly structured amyloid fibrils. Aggregation of insulin leads to loss of activity and can trigger an unwanted immune response. Compounds that prevent protein aggregation have been used to stabilize insulin; these co…
A comprehensive and chronological account of dendrimers based on [1,3,5]-triazines is provided. Synthetic strategies to install the triazine through cycloaddition, cyclotrimerization, and nucleophilic aromatic substitution of cyanuric chloride are discussed. Motivations and applications of these architectures are surv…
Abstract The direct preparation of grafting polymer brushes from commercial poly (vinylidene fluoride) (PVDF) films with surface‐initiated atom transfer radical polymerization (ATRP) is demonstrated. The direct initiation of the secondary fluorinated site of PVDF facilitated grafting of the hydrophilic monomers from t…
Two-dimensional (2D) honeycomb photonic crystals with cylinders and connecting walls have the potential to have a large full band gap. In experiments, 2D photonic crystals do not have an infinite height, and therefore, we investigate the effects of the thickness of the walls, the height of the slabs and the type of th…
(Sr 1 - x, Zn x ) 1 - y (Al 1.98, B 0.02 )O 4:Eu y 2+ green phosphor particles for ultraviolet light-emitting diodes (UV LEDs) were prepared by spray pyrolysis and their luminescent properties were investigated with changing the reducing temperature, the concentration of the activator, and the ratio of Sr to Zn. For t…
Absorption spectroscopy of stretch-aligned single-walled carbon nanotube (SWNT)/polymer composite films from the terahertz through the visible region of the electromagnetic spectrum reveal that the peak centered near 100 cm–1 is highly polarized along the tube axis (see figure). This result provides new information on…
Photoconductivity is observed in ZnO epilayers due to photoexcitation in the visible spectral region of 400–700 nm, below the ZnO bandgap energy of 3.4 eV. Photoconductive transients due to visible photoexcitation have time constants in the order of minutes. Treatment of the ZnO surface with SiO2 passivation layers re…
The magnetic nature of Cs$_{2}$AgF$_{4}$, an isoelectronic and isostructural analogue of La$_2$CuO$_4$, is analyzed using density functional calculations. The ground state is found to be ferromagnetic and nearly half metallic. We find strong hybridization of Ag-$d$ and F-$p$ states. Substantial moments reside on the F…
The effect of high magnetic fields on the current carrying properties of both MgB2 bulks and Fe-sheathed tapes was investigated following different thermal sequences. It is found that application of a large magnetic field during processing results in the quite uniform microstructure and the better connectivity between…