Combined effects of electric field and hydrostatic pressure on electron states in asymmetric GaAs/(Ga,Al) triple quantum dots

The combined effects of an in-growth direction applied electric field and hydrostatic pressure on the exciton binding energy and photoluminescence energy transitions are reported in this work for triple vertically coupled quantum dots. The calculations have been carried out within the effective mass approximation, and using a variational procedure. The results show that the exciton binding energy and the photoluminescence energy transitions are functions of external probes like the hydrostatic pressure and the applied electric field.     

An improved error bound for a finite element approximation of a model for phase separation of a multi-component alloy

Using the approach of Rulla (1996 SIAM J. Numer. Anal. 33, 68-87)for analysing the time discretization error and assuming moreregularity on the initial data, we improve on the error boundderived by Barrett and Blowey (1996 IMA J. Numer. Anal. 16,257-287) for a fully practical piecewise linear finite elementapproximation with a backward Euler time discretization of amodel for phase separation of a multi-component alloy.     

Laser printing of enamels on tiles

A Nd:YAG laser beam is used as a tool to print patterns of coloured enamels on tile substrates. For this, the laser beam is scanned over a layer of raw enamel previously sprayed on the tile surface. The possibility to focus the laser energy to heat a small zone without affecting the rest of the piece presents some advantages in front of traditional furnace techniques in which the whole piece has to be heated; among them, energy saving and the possibility to apply enamels with higher melting temperatures than those of the substrate. In this work, we study the effects of laser irradiation of a green enamel, based in chromium oxide pigment and lead frit, deposited on a white tile substrate. Lines obtained with different combinations of laser beam power and scan speeds were investigated with the aim to optimize the process from the point of view of the quality of the patterns. For this purpose, the morphology of the lines and their cross-sections is studied. The results show that lines with good visual properties can be printed with the laser. The characteristics of the marked lines were found to be directly related with the accumulated energy density delivered. Moreover, there is a linear relationship between the accumulated energy density and the volume of melted material. A minimum accumulated energy density is required to melt a shallow zone of the glazed substrate to allow the adhesion of the enamelled lines.     

The retro-aldol mechanism in the pyrolysis kinetics of primary,secondary, and tertiary β-hydroxy ketones in the gas phase

The pyrolysis kinetics of primary, secondary, and tertiary β-hydroxy ketones have been studied in static seasoned vessels over the pressure range of 21–152 torr and the temperature range of 190°–260°C. These eliminations are homogeneous, unimolecular, and follow a first-order rate law. The rate coefficients are expressed by the following equations: for 1-hydroxy-3-butanone, log k₁(s^?1) = (12.18 ± 0.39) ? (150.0 ± 3.9) kJ mol^?1 (2.303RT)^?1; for 4-hydroxy-2-pentanone, log k₁(s^?1) = (11.64 ± 0.28) ? (142.1 ± 2.7) kJ mol^?1 (2.303RT)^?1; and for 4-hydroxy-4-methyl-2-pentanone, log k₁(s^?1) = (11.36 ± 0.52) ? (133.4 ± 4.9) kJ mol^?1 (2.303RT)^?1. The acid nature of the hydroxyl hydrogen is not determinant in rate enhancement, but important in assistance during elimination. However, methyl substitution at the hydroxyl carbon causes a small but significant increase in rates and, thus, appears to be the limiting factor in a retroaldol type of mechanism in these decompositions. © John Wiley & Sons, Inc.     

Preparation of polymer-supported gold nanoparticles based on resins containing ionic liquid-like fragments: easy control of size and stability

Crosslinked polymers containing covalently attached functional sites with chemical structures related to those present in ILs and having macroscopic properties very similar to the ones of the corresponding bulk ILs can be advantageously applied to the preparation of gold nanoparticles (AuNPs). The size and morphology of the resulting metal nanoparticles (MNPs) can be easily modulated through a proper combination of the synthetic method used for the generation of the NPs and the structural elements of the polymer. Additionally, the resulting supported AuNPs are demonstrated to be stable for at least eight months with the vials open to the atmosphere. Several synthetic methodologies have been studied, as well as different structural parameters for the functional polymers. Those include the chemical nature (anions and cations) and loading of the ionic liquid-like fragments and the morphology of the polymeric matrix. The results obtained show the potential to prepare supported AuNPs with narrow size distributions and small diameters that can have potential interest for application in different fields.     

Low-energy charge-density excitations in MgB2: Striking interplay between single-particle and collective behavior for large momenta

A sharp feature in the charge-density excitation spectra of single-crystal MgB2, displaying a remarkable cosinelike, periodic energy dispersion with momentum transfer (q) along the c* axis, has been observed for the first time by high-resolution nonresonant inelastic x-ray scattering (NIXS). Time-dependent density-functional theory calculations show that the physics underlying the NIXS data is strong coupling between single-particle and collective degrees of freedom, mediated by large crystal local-field effects. As a result, the small-q collective mode residing in the single-particle excitation gap of the B pi bands reappears periodically in higher Brillouin zones. The NIXS data thus embody a novel signature of the layered electronic structure of MgB2.     

Scale dependence of branching in arterial and bronchial trees

Although models of branching in arterial and bronchial trees often predict a dependence of bifurcation parameters on the scale of the bifurcating vessels, direct verification of this dependence by comparison with data is uncommon. We compare measurements of bifurcation parameters of airways and arterial trees of different mammals as a function of scale to general features predicted by theoretical models based on minimization of pumping power and network volume. We find that the size dependence is more complex than existing theories based solely on energy and volume minimization explain, and suggest additional factors that may govern the branching at different scales.     

Analysis of Renal Cell Carcinoma Cell Response to the Enhancement of 5-aminolevulinic Acid-mediated Protoporphyrin IX Fluorescence by Iron Chelator Deferoxamine†

As a tumor photodiagnostic agent, 5-aminolevulinic acid (ALA) is metabolized in the heme biosynthesis pathway to produce protoporphyrin IX (PpIX) with fluorescence. ALA-PpIX fluorescence was evaluated in human renal cell carcinoma (RCC) cell lines and non-tumor HK-2 cell lines. We found that extracellular PpIX level was correlated with ABCG2 activity, illustrating its importance as a PpIX efflux transporter. Extracellular PpIX was also related to the K_m of ferrochelatase (FECH) that chelates PpIX with ferrous iron to form heme. The V_max of FECH was higher in all RCC cell lines tested than in the HK-2 cell line. TCGA dataset analysis indicates a positive correlation between FECH expression and RCC patient survival. These findings suggest FECH as an important biomarker in RCC. Effects of iron chelator deferoxamine (DFO) on the enhancement of PpIX fluorescence were assessed. DFO increased intracellular PpIX in both tumor and non-tumor cells, resulting in no gain in tumor/non-tumor fluorescence ratios. DFO appeared to increase ALA-PpIX more at 1-h than at 4-h treatment. There was an inverse correlation between ALA-PpIX fluorescence and the enhancement effect of DFO. These results suggest that enhancement of ALA-PpIX by DFO may be limited by the availability of ferrous iron in mitochondria following ALA administration.     

Three dissimilarity measures to contrast dendrograms

We discussed three dissimilarity measures between dendrograms defined over the same set, they are triples, partition, and cluster indices. All of them decompose the dendrograms into subsets. In the case of triples and partition indices, these subsets correspond to binary partitions containing some clusters, while in the cluster index, a novel dissimilarity method introduced in this paper, the subsets are exclusively clusters. In chemical applications, the dendrograms gather clusters that contain similarity information of the data set under study. Thereby, the cluster index is the most suitable dissimilarity measure between dendrograms resulting from chemical investigation. An application example of the three measures is shown to remark upon the advantages of the cluster index over the other two methods in similarity studies. Finally, the cluster index is used to measure the differences between five dendrograms obtained when applying five common hierarchical clustering algorithms on a database of 1000 molecules.