Two-dimensional modelling of multifrequency piezocomposites

The multifrequency composites of 2-2 connectivity modelled in this work are made with groups of piezoelectric elements of different lateral dimensions, periodically reproduced in the structure. These composites have potential to improve the performances of standard piezoelectric composites with the same materials and ceramic fraction, on account that they have different resonators coupled mechanically along the structure. A one-dimensional model was developed to study their performances in a first approximation. In order to obtain a design model, a two-dimensional model, previously used to describe multielement array transducers, has been extended to the case of 2-2 polymer-piezoceramic composites. Several composite samples, having piezoceramic strips with different width-to-thickness ratios, have been built, and their resonance behaviour compared with the model prediction. Finally, the model has been extended to the case of 2-2 multifrequency composites. For multifrequency composites having in the same composite structure two or three piezoceramic strips with different lateral dimensions, the comparison between experimental and predicted results shows good agreement. The model has been used to optimise a double composite in comparison with a standard one with the same volume fraction and constituents.     

Theoretical model of internal rotation in monosubstituted derivatives of furfural

The present work explores the effect of substitution in all free positions of furfural on conformational preferences of formyl group by using ab-initio calculations at the MP2/6-31G(p,d) level of theory. Theoretical modeling was made in vacuo. The selected substituents were -CH(3), NH(2), NO(2) and F groups in 3, 4, 5 and ipso carbonyl positions. Geometries of all derivatives were analyzed and it is ascertained that substitution has not important consequences on furan ring geometry. Differences of energy between OO-cis and trans conformers and energy barriers between them are described and extreme cases are explained. Interesting features appear in the cases of -NH(2) and -NO(2) groups, and particularly when the 3 and ipso carbonyl positions are substituted. Variations in energy barriers are correlated with variations in C2-C6 distances for the transition states and planar forms. Substitution effect on Mülliken charges are analyzed and related with internal rotation energy barriers and differences between conformers.     

64 elements two-dimensional piezoelectric array for 3D imaging

Ultrasound has a large potential on non-invasive inspection with main applications in medical imaging and non-destructive testing (NDT). The increasing interest in 3D imaging applications leads to investigate new solutions for two-dimensional (2D) ultrasonic arrays with an affordable number of electronic channels without resolution degradation. 2D segmented annular arrays (SAAs) are a good compromise between resolution--image quality--and number of electronically active channels. A 1-3 piezoelectric composites are used as basis material to manufacture the array transducers due to their low planar coupling and high electromechanical coupling coefficients. A 1.5 MHz SAA of 64 elements and 20 mm of diameter was designed, manufactured and tested. The design key point is the use of a flexible circuit with electrodes and tracks that define the array geometry. The piezocomposite was used as a monolithic support. Soft backing and one matching layer were used. The array elements have been tested electrically and acoustically showing good agreement with a KLM-based simulation model. Acoustical field measurements in water at different steering angles were made and compared with simulations performed with a model that uses an exact solution of the impulse response approach. Side lobes are important because the array geometry used was designed to work in metals for NDT purposes. Smaller array elements should be made for medical applications.     

Simple and efficient synthesis of new chiral N,N′‐sulfonyl bis‐oxazolidin‐2‐ones

A series of new chiral N,N′‐sulfonyl bis‐oxazolidin‐2‐ones were synthesized starting from 2‐aminoalcohols, sulfuryl chloride, and diethyl carbonate. This method utilizes natural amino acids as a source of chirality for the preparation of oxazolidinones. © 2006 Wiley Periodicals, Inc. Heteroatom Chem 17:61–65, 2006; Published online in Wiley InterScience ( www.interscience.wiley.com ). DOI 10.1002/hc.20183     

Phase Diagram for a System of Polydisperse Components Consisting of the Precursor of an Epoxy/Diamine Thermoset and a Thermoplastic: Analysis Based on a Lattice Theory Model

Summary: The miscibility of a thermoplastic modifier with the precursors of an epoxy/diamine thermoset without chemical reaction was studied thermodynamically. The experimental cloud point curve showed a UCST behavior. A model based on the Flory‐Huggins lattice theory and on the Koningsveld approach was used for the thermodynamic analysis, in which the polydispersity of components was taken into account and the interaction parameter was considered depending on the temperature and composition. A phase diagram for the unreacted system was obtained. Calculations of species distributions in both separated phases were realized for different compositions of the modifier. Finally, the miscibility of our system was compared with that of the same system without diamine, obtaining a greater miscibility in the system with diamine.

Phase diagram for the system formed by the precursors of an epoxy thermoset without chemical reaction modified with different amounts of polystyrene.     

Biomass-derived electrodes for flexible supercapacitors

At present, supercapacitors constitute, along with batteries, one of the most promising electrochemical energy storage technology. The recent emerging generation of bendable portable electronic devices has boosted the research of new materials, new processing techniques and new designs that can meet the demands in terms of mechanical stability upon bending or stretching, without compromising their electrochemical performance, at an acceptable cost. Among all the electrode materials currently explored, biomass-derived carbons hold a great potential, due to their low-cost, easy processing techniques, stability and versatility. Here we introduce the range of renewable precursors available and current state-of-the-art performances, and explore the challenges regarding flexibility and sustainability.     

Reactions of methyl esters of adamantane acids with acetonitrile

Russian Chemical Bulletin - Methyl adamantane-1-carboxylate and methyl (1-adamantyl)acetate react with acetonitrile in the presence of sodium hydride to give 3-(1-adamantyl)-3-oxopropanenitrile and...