Search results for "SHELL"
showing 10 items of 748 documents
Stability and synthesis of superheavy elements: Fighting the battle against fission – example of $^{254}$No
2016
International audience; Superheavy nuclei exist solely due to quantum shell effects,which create a pocket in the potential-energy surface of the nucleus, thusproviding a barrier against spontaneous fission. Determining the height ofthe fission barrier and its angular-momentum dependence is important toquantify the role that microscopic shell corrections play in enhancing andextending the limits of nuclear stability. In this talk, the first measurement ofa fission barrier in the very heavy nucleus 254No will be presented.
Short and Medium Range Order in Se1-xTexGlasses
1997
Complementary XAFS measurements (LURE and NSLS) of Se 1 - x Te x glasses have been carried out on both the Se and Te K-edges at low and room temperatures. Using a multi-shell best fit analysis procedure, we have reconstructed the Se and Te local environment: (i) first shell intrachain nearest neighbors (Se-Se 1 , Se-Te 1 , Te-Se 1 ,and Te-Te 1 ); (ii) second shell intrachain (Se-Se 2 and Se-Te 2 ) and interchain next nearest neighbors (Se⇔Se 3 single scattering in the chains Se-Se 1 -Se 3 and Se-Te 1 -Se 3 ). For the first and second coordination shells we suggest that the intrachain chemical order increases with Te content. On the other hand, we propose a model of random distribution of Se…
Shell structure and the fluctuation of the nuclear density distribution
1984
We investigate the relation between the density-fluctuations in nuclei and their description by single-particle models, i.e. the shell model and the Hartree-Fock method; the question is whether every shell-structure necessarily leads to those fluctuations. We demonstrate the flexibility of the single-particle models by constructing a shell-model potential and an effective Hartree-Fock potential, respectively, which produce completely flat distributions without any density fluctuation; this means that “shell structure” is not sufficient an explanation for the fluctuations. Only the additional requirement that the dynamical features of nuclei are also met selects a subclass of “reasonable” po…
Use of The Eggshells in Removing Heavy Metals from Waste Water - The Process Kinetics and Efficiency
2019
Abstract Studies of the efficiency of Ni, Cu and Cd cations removal from water solutions were carried out, with the use of clay limestone, hen eggshells from eggs for consumption and hen eggshells after hatching, which main element is calcium carbonate. Hen eggshells are a waste product, which can be used as a substitute of clay limestone in removing heavy metals from wet flue gas desulphurisation installation. Mixed solutions of Ni, Cu and Cd were used in the research, with the composition similar to the waste water from wet flue gas desulphurisation installation: Ni (0.009-0.053 mmol/dm3), Cu (0.008-0.057 mmol/dm3) and Cd (0.003-0.008 mmol/dm3). The metals were determined by flame atomic …
Enhanced [4+2] cycloadditions by solvophobic effects and gravity-induced mixing in core-shell droplets
2017
A new way to perform reactions in core—shell double emulsions is reported herein. The phase boundaries of the threephase droplet flow were used to pressurize the reactants in the shell liquid, enhancing the reaction rate of a cycloaddition greatly in comparison to known methods. As key parameters, solvophobic effects and precise control over the droplet sizes were used to exploit a reaction with a negative volume of activation. The internal pressure of the reaction solution was regulated purely by the thickness of the shell liquid without adding additional reagents. Additionally, the reaction performed better when the core droplet was used to stir the shell droplet, considerably improving t…
CFD prediction of shell-side flow and mass transfer in regular fiber arrays
2021
Numerical simulations were conducted for fully developed, steady-state flow with mass transfer in fiber bundles arranged in regular lattices. The porosity was 0.5 and the Schmidt number 500. Several combinations of axial flow, transverse flow and flow attack angles in the cross-section plane were considered. The axial and transverse Reynolds numbers Rez , ReT were made to vary from 10(^−4) to 10(^2). Concentration boundary conditions, and the definition of an average Sherwood number, were addressed. Results for the hydraulic permeability were compared with the literature. Both hexagonal and square lattices were found to be hydraulically almost isotropic up to transverse flow Reynolds number…
Enhancement of heat exchanger thermal hydraulic performance using aluminum foam
2018
Abstract This paper deals with an experimental study of a turbulent forced convection in a rectangular channel partly fitted with aluminum metallic foam blocks. Experiments were carried out on samples having a constant porosity of 93.8%, different grades of 5, 20 and 40 PPI, and three different height ratios of 0.6, 0.8 and 1. The blocks were arranged in a baffle like configuration. A constant heat flux of 2 W/cm2 was applied on the bottom wall of the test section, while air velocity was varied from 1 to 5 m·s−1. Temperatures of the wall along the flow direction as well as those of the inlet and outlet sections have been measured. Additionally, pressure drop measurements across the aluminum…
The mechanism of formamide hydrolysis in water from ab initio calculations and simulations.
2005
The neutral hydrolysis of formamide in water is a suitable reference to quantify the efficiency of proteolytic enzymes. However, experimental data for this reaction has only very recently been obtained and the kinetic constant determined experimentally is significantly higher than that predicted by previous theoretical estimations. In this work, we have investigated in detail the possible mechanisms of this reaction. Several solvent models have been considered that represent a considerable improvement on those used in previous studies. Density functional and ab initio calculations have been carried out on a system which explicitly includes the first solvation shell of the formamide molecule…
Core hole screening and decay rates of double core ionized first row hydrides.
2013
Because of the high intensity, X-ray free electron lasers allow one to create and probe double core ionized states in molecules. The decay of these multiple core ionized states crucially determines the evolution of radiation damage in single molecule diffractive imaging experiments. Here we have studied the Auger decay in hydrides of first row elements after single and double core ionization by quantum mechanical ab initio calculations. In our approach the continuum wave function of the emitted Auger electron is expanded into spherical harmonics on a radial grid. The obtained decay rates of double K-shell vacancies were found to be systematically larger than those for the respective single …
Analysis of the Electronic Structure of Non-Spherical Ligand-Protected Metal Nanoclusters: The Case of a Box-Like Ag67
2016
In this work we introduce a new strategy to investigate the electronic shell structure of ligand-protected metal nanoclusters of polyhedral core shape. The central idea is to identify the symmetry of the Kohn–Sham molecular orbitals of an atomistic structure based on their projection onto the electronic states of a jellium system with a similar shape of the background charge density. Herein, we study the connection between a reduced atomistic model of the recently reported box-like [Ag67(SR)32(PR3)8]3+ nanocluster and a jellium box consisting of 32 free electrons. With this approach, we determine the symmetry of electronic states of the metal core and identify those that are involved in the…