Search results for "SHELL"
showing 10 items of 748 documents
New Alternative in the Methodology of Extraction and Dyeing with Active Molecules Derived from Vegetal Sources
2016
Abstract The general objective of this study refers to the identification of a sustainable and physical methodology of extraction of active compounds, envisaging the preservation of the high purity active natural dye molecule from nut shell (juglone), even under the conditions of an extraction performed in a mixt solvent medium (water-ethanol). The second major objective of the study consists of the application of these above mentioned dyes onto natural and synthetic substrates, thus making a correlation between their colour attributes and the fibrous composition of the substrates they are applied on. The motivation of this research was given by the identification of an improved extraction …
Effects of a phycotoxin, okadaic acid, on oyster heart cell survival
2008
Okadaic acid (OA) is a dinoflagellate toxin which accumulates in shellfish producing diarrhetic shellfish poisoning (DSP) in humans. It was found that OA is a highly selective inhibitor of protein phosphatase types 1 (PP1) and 2A (PP2A) which produces a marked increase in phosphorylation of several proteins, including p38 mitogen-activated protein (MAP) kinase. The cytotoxicity attributed to OA and the effects on p38 MAP kinase and calcium current were examined in the oyster Crassostrea gigas in this study. Data showed that p38 MAP kinase is strongly expressed in oyster heart and that OA bioaccumulated in cultured heart cells. Hence the effects of OA was tested in vitro and in vivo on oyste…
A simple tool to forecast the natural frequencies of thin-walled cylinders
2023
Abstract. This paper presents an approximate method to predict the natural frequencies of thin-walled cylinders. By taking inspiration from a previous work of one of the authors, the starting point of the proposed approach is a proper construction of reasonable eigenfunctions. However, a new simple tool based on the principle of virtual work has been developed to estimate the natural frequencies and the amplitude of vibration without complex numerical resolution. Moreover, the applicability of the model is extended to all the most common constraint conditions. The identification of the natural frequencies of a continuous cylinder is reduced to an eigenvalue problem based on a matrix whose e…
About the evaluation of the local kinetic, potential and total energy densities in closed-shell interactions
2001
Abstract The local kinetic G( r ) , potential V( r ) and total E( r ) energy densities, calculated at the critical points of 37 H⋯F closed-shell interactions by quantum mechanical methods, have been compared to their estimated values obtained by using an approximate evaluation of G( r ) and the local form of the virial theorem. The results presented here show very small differences between the corresponding quantities, and therefore support the validity of the estimations. Thus, the equations used in this procedure provide useful information for topological studies of experimental electron densities, permitting the evaluation of those energetic properties from the modelling of the topologic…
A Coherent derivation of an average ion model including the evolution of correlations between different shells
2013
We propose in this short note a method enabling to write in a systematic way a set of refined equations for average ion models in which correlations between populations are taken into account, starting from a microscopic model for the evolution of the electronic configura- tion probabilities. Numerical simulations illustrating the improvements with respect to standard average ion models are presented at the end of the paper.
Practice and assessment of oral skills in developing online preparatory materials through the InGenio authoring shell
2012
The practice of oral skills is a basic requirement of learning or teaching a new language, as one of the main goals in the field of language learning is developing oral communicative competence, especially needed in contexts where the students¿ L2 is the vehicular language and therefore the main means of interaction. The InGenio online authoring tool allows designers of new materials, as well as language teachers and students, to rethink and imagine new ways of dealing with practice and assessment of listening and speaking skills thanks to the flexibility of its templates, resources and tools. This article explores the ways in which the InGenio utilities, solutions and learning materials ar…
Discontinuous Galerkin models for composite multilayered shells with higher order kinematics
2021
Composite multilayered shells are widely employed in aerospace, automotive and civil engineering as weight-saving structural components. In multilayered shells, despite its versatility, the interplay between the curved geometry and the properties of the composite layers induces a complex distribution of the mechanical fields, which must be accurately resolved to safely employ generally curved composite shells as load-bearing structures. The problem can be addressed through the two-dimensional shell theories, which are based on suitable assumptions on the behavior of the mechanical fields throughout the thickness of the considered structures and are a viable strategy for reducing the computa…
Vertical spectrum of the C2H 2+ system. An open shell (SC)2-CAS-SDCI study
2003
The open shell (SC)(2)-CAS-SDCI method along with a basis set of atomic natural orbitals (ANO) has been applied for calculating the main ionization potentials of acetylene, as well as the manifold of excited states of the different symmetries up to 32 eV. In this method, the single and double excitations of a CAS space are generated and the corresponding CI matrix is corrected by means of the (SC)(2) procedure that cancels the size-extensivity error and adds some high order contributions. The mean absolute error for the outer-valence X (2)Pi(u)(1pi(u) (-1)), A (2)Sigma(g) (+)(3sigma(g) (-1)), and B (2)Sigma(u) (+)(2sigma(u) (-1)) states, and the inner-valence C (2)Sigma(g) (+)(2sigma(g) (-1…
Neutral-Current Neutrino-Nucleus Scattering off Xe Isotopes
2018
Large liquid xenon detectors aiming for dark matter direct detection will soon become viable tools also for investigating neutrino physics. Information on the effects of nuclear structure in neutrino-nucleus scattering can be important in distinguishing neutrino backgrounds in such detectors. We perform calculations for differential and total cross sections of neutral-current neutrino scattering off the most abundant xenon isotopes. The nuclear structure calculations are made in the nuclear shell model for elastic scattering, and also in the quasiparticle random-phase approximation (QRPA) and microscopic quasiparticle phonon model (MQPM) for both elastic and inelastic scattering. Using suit…
Thermal Expansion in Small Metal Clusters and its Impact on the Electric Polarizability
2000
The thermal expansion coefficients of $\mathrm{Na}_{N}$ clusters with $8 \le N \le 40$ and $\mathrm{Al}_{7}$, $\mathrm{Al}_{13}^-$ and $\mathrm{Al}_{14}^-$ are obtained from {\it ab initio} Born-Oppenheimer LDA molecular dynamics. Thermal expansion of small metal clusters is considerably larger than that in the bulk and size-dependent. We demonstrate that the average static electric dipole polarizability of Na clusters depends linearly on the mean interatomic distance and only to a minor extent on the detailed ionic configuration when the overall shape of the electron density is enforced by electronic shell effects. The polarizability is thus a sensitive indicator for thermal expansion. We …