Theoretical study on the structures and electronic spectra of TCNE2-.

Investigations into the charge-separated states and electron-transfer transitions in tetracyanoethylene (TCNE) complexes have recently generated much interest. In this work we present theoretical calculations showing that the most stable structure of the dianion TCNE2- has D2d symmetry in vacuum as well as in the solvents dichloromethane and acetonitrile. By means of the coupled cluster linear response, we compute the vertical electronic spectrum in both the gas phase and solution. The theoretical results are compared to the experimental data and good agreement is achieved.     

Melting of heterogeneous vortex matter: The vortex ‘nanoliquid’

Disorder and porosity are parameters that strongly influence the physical behavior of materials, including their mechanical, electrical, magnetic and optical properties. Vortices in superconductors can provide important insight into the effects of disorder because their size is comparable to characteristic sizes of nanofabricated structures. Here we present experimental evidence for a novel form of vortex matter that consists of inter-connected nanodroplets of vortex liquid caged in the pores of a solid vortex structure, like a liquid permeated into a nanoporous solid skeleton. Our nanoporous skeleton is formed by vortices pinned by correlated disorder created by high-energy heavy ion irradiation. By sweeping the applied magnetic field, the number of vortices in the nanodroplets is varied continuously from a few to several hundred. Upon cooling, the caged nanodroplets freeze into ordered nanocrystals through either a first-order or a continuous transition, whereas at high temperatures a uniform liquid phase is formed upon delocalization-induced melting of the solid skeleton. This new vortex nanoliquid displays unique properties and symmetries that are distinct from both solid and liquid phases.     

Barycentric systems and stretchability

Using a general resolution of barycentric systems we give a generalization of Tutte's theorem on convex drawing of planar graphs. We deduce a characterization of the edge coverings into pairwise non-crossing paths which are stretchable: such a system is stretchable if and only if each subsystem of at least two paths has at least three free vertices (vertices of the outer face of the induced subgraph which are internal to none of the paths of the subsystem). We also deduce that a contact system of pseudo-segments is stretchable if and only if it is extendible.     

Growth of InAs nanostructures on InP using atomic-force nanolithography

Atomic-force nanolithography was used to control the nucleation sites of InAs nanostructures on InP substrates. Indentations with a wide range of dimensions were produced on InP. InAs nanostructures were selectively grown by metal organic vapor phase epitaxy. It is shown that the number of active nucleation sites depends on the normal force applied during nanoindentation. Crystalline defects introduced by nanoindentation are shown to be nucleation sites for these nanostructures. The presence of screw dislocations within the grown nanostructures further supports this observation. PACS 81.07.-b; 68.37.Ps; 81.16.Nd     

A novel approach based on recurrent neural networks applied to nonlinear systems optimization

This paper presents an efficient approach based on recurrent neural network for solving nonlinear optimization. More specifically, a modified Hopfield network is developed and its internal parameters are computed using the valid subspace technique. These parameters guarantee the convergence of the network to the equilibrium points that represent an optimal feasible solution. The main advantage of the developed network is that it treats optimization and constraint terms in different stages with no interference with each other. Moreover, the proposed approach does not require specification of penalty and weighting parameters for its initialization. A study of the modified Hopfield model is also developed to analyze its stability and convergence. Simulation results are provided to demonstrate the performance of the proposed neural network.     

Detection of hepatocarcinoma in rats by integration of the fluorescence spectrum: Experimental model

The incorporation of spectroscopic techniques into diagnostic procedures may greatly improve the chances for precise diagnostics. One promising technique is fluorescence spectroscopy, which has recently been used to detect many different types of diseases. In this work, we use laser-induced tissue fluorescence to detect hepatocarcinoma in rats using excitation light at wavelengths of 443 and 532 nm. Hepatocarcinoma was induced chemically in Wistar rats. The collected fluorescence spectrum ranges from the excitation wavelength up to 850 nm. A mathematical procedure carried out on the spectrum determines a figure of merit value, which allows the detection of hepatocarcinoma. The figure of merit involves a procedure which evaluates the ratio between the backscattered excitation wavelength and the broad emission fluorescence band. We demonstrate that a normalization allowed by integration of the fluorescence spectra is a simple operation that may allow the detection of hepatocarcinoma.     

Synchrotron radiation total reflection X-ray fluorescence (SR-TXRF) for evaluation of food contamination

Summary The objective of this study was to use synchrotron radiation total reflection X-ray fluorescence analysis (SR-TXRF) for the determination of metals and other elements in food available to the population in commercial establishments, in order to evaluate the risks of contamination by these products. The analyzed species were vegetables, leafy vegetables, fruits, cereal and grain. The results indicated that some species were contaminated by Cr, Cu, Zn and Pb with concentrations much higher than the reference values.     

On the Weak Invariance Principle for Stationary Sequences under Projective Criteria

In this paper, we study the central limit theorem and its weak invariance principle for sums of a stationary sequence of random variables, via a martingale decomposition. Our conditions involve the conditional expectation of sums of random variables with respect to the distant past. The results contribute to the clarification of the central limit question for stationary sequences. Magda Peligrad is supported in part by a Charles Phelps Taft research support grant at the Univeristy of Cincinnati and the NSA grant H98230-05-1-0066.     

Electrochemical impedance spectroscopy and linear polarization applied to evaluation of porosity of phosphate conversion coatings on electrogalvanized steels

In this work, electrochemical impedance spectroscopy and linear polarization are used in determining porosity of zinc phosphates, and of nickel and manganese modified zinc phosphates on electrogalvanized steel. The porosity of the phosphate layers ranges from 0.1% for the manganese-modified hopeite to 8% for hopeite, using the linear polarization and the electrochemical impedance spectroscopy techniques. The porosity values measured using the two techniques were in agreement. All impedance spectra of coated samples showed two steps, with two capacitive arcs and an inductive looping.