Search results for "dynamics."
showing 10 items of 9637 documents
O Brasil na rota das migrações internacionais qualificadas espanholas no século XXI
2018
In order to understand recent migration, it is crucial to analyze the migratory modalities such as skilled international migration to Brazil, especially considering the ongoing transnational economic processes and their effects on the corresponding societies. Therefore, this article seeks to understand how the migratory dynamics of highly skilled Spanish professionals to the country are established taking into account the theoretical contribution of the circulation of brains and the category of knowledge workers. For this purpose, information from Brazilian?s Ministry of Labor is used on labor authorizations, financial contributions and insertion in the formal market in Spain; as well as da…
Structural Origin of Metal Specificity in Isatin Hydrolase from Labrenzia aggregata Investigated by Computer Simulations.
2017
We performed quantum-chemical calculations, ab initio molecular dynamics, hybrid quantum mechanics/molecular mechanics (QM/MM) and enhanced sampling metadynamics simulations to investigate the origin of metal specificity in isatin hydrolase from Labrenzia aggregata. The peculiar octahedral binding geometry of the Mn2+ ion in the Michaelis complex includes both the isatin substrate and the catalytic water within the first coordination shell of the cation. Our calculations show that the same arrangement of the ligands cannot be efficiently achieved in the presence of other small divalent metal cations such as Zn2+ or Cu2+ . On the contrary, bulkier alkaline-earth cations such as Mg2+ , which …
Characterization of gas flow through low-permeability claystone: laboratory experiments and two-phase flow analyses
2014
For the characterization of gas migration through a low-permeability clay host rock for deep underground repositories, a comprehensive understanding of the relevant phenomena of gas and fluid flow through low-permeability clay is required. The National Cooperative for the Disposal of Radioactive Waste (Nagra) in Switzerland has developed a comprehensive programme to characterize gas flow in low-permeability Opalinus Clay through laboratory tests and detailed numerical analyses for developing appropriate constitutive models. Laboratory tests were performed on cores by two different laboratories, the Laboratory for Soil Mechanics at EPFL and the Department of Geotechnical Engineering and Geos…
Water Fluxes in Polymeric Membranes for Desalination via Membrane Distillation
2010
Membrane distillation is an emerging technique for seawater desalination. Hydrophobic polymeric membranes are used to separate the solute‐free water vapour from the hot solution. Vapour fluxes of commercial polymeric membranes were measured in various conditions, i.e. natural and forced convection and vacuum. Vapour fluxes were also predicted with models and compared with experimentals. Higher fluxes were recorded in vacuum conditions.
Adsorption and desorption surface dynamics of gaseous adsorbate on silicate-1 by molecular dynamics simulation
2013
The dynamics of adsorption and desorption of gaseous molecules on the external surface of a crystal and a membrane of zeolite silicate-1 is investigated by molecular dynamics simulation. The gases ...
Modeling of surface vs. bulk ionic conductivity in fixed charge membranes
2003
A two-region model for describing the conductivity of porous fixed charge membranes is proposed. In the surface region, the conductivity is due to the mobile positive ions (counterions) around the negative fixed charges. In the pore center region, the conductive properties resemble those of the external electrolyte solution because the fixed charges are assumed to be effectively neutralized by the counterions in the surface region. Activation energies and surface diffusion coefficients are estimated by assuming that the counterion jump from a fixed charge group is the rate limiting process for surface transport. The barrier energy for this jump is calculated using a simple electrostatic mod…
Hydration dependence of myoglobin dynamics studied with elastic neutron scattering, differential scanning calorimetry and broadband dielectric spectr…
2014
In this work we present a thorough investigation of the hydration dependence of myoglobin dynamics. The study is performed on D2O-hydrated protein powders in the hydration range 0<h<0.5 (h≡gr[D2O]/gr[protein]) and in the temperature range 20-300K. The protein equilibrium fluctuations are investigated with Elastic Neutron Scattering using the spectrometer IN13 at ILL (Grenoble), while the relaxations of the protein + hydration water system are investigated with Broadband Dielectric Spectroscopy; finally, Differential Scanning Calorimetry is used to obtain a thermodynamic description of the system. The effect of increasing hydration is to speed up the relaxations of the myoglobin + hydration …
Numerical relativity simulations of tilted black hole-torus systems
2016
Las fusiones de objetos compactos se encuentran entre los eventos más interesantes de la astrofísica relativista, siendo, en particular, el principal objetivo de la astronomía de ondas gravitatorias. En esta tesis investigamos los posibles estados finales de la fusión de sistemas binarios formados por agujero negro-estrella de neutrones o por dos estrellas de neutrones: discos gruesos (o toros) de acrecimiento alrededor de agujeros negros en rotación tipo Kerr. Estos sistemas agujero negro-toro se cree que constituyen el motor central de los eventos más luminosos del Universo: los llamados estallidos de rayos gamma. Nuestro conocimiento sobre la evolución y la estabilidad de estos sistemas …
Analytical solutions of magnetohydrodynamical problems on a flow of conducting fluid in the entrance region of channels in a strong magnetic field šķ…
2014
Darbā iegūti analītiskie atrisinājumi magnetohidrodinamiskiem (MHD) uzdevumiem par elektrovadoša šķidruma plūsmu plakanā un cilindriskā kanālā stiprā magnētiskā laukā gadījumiem, kad šķidrums ietek kanālos caur galīga platuma spraugu vai caur galīga rādiusa atveri kanāla sānu malā. Pamatojoties uz iegūtajiem atrisinājumiem, veikta plūsmas ātruma lauka skaitliskā analīze. Iegūti uzdevumu asimptotiskie atrisinājumi lieliem Hartmana skaitļiem. Turklāt darbā pētīta pilna spiediena spēka šķidruma ieplūdes apgabalā atkarība no funkcijas veida, ar kuru ir uzdots ātruma robežnosacījums. Pētījums veikts analītiski, risinot divas hidrodinamiskas problēmas un divas MHD problēmas par viskoza šķidruma i…
Distribution and generation of traps in SiO2/Al2O3 gate stacks
2007
In this work we combine charge-pumping measurements with positive constant voltage stress to investigate trap generation in SiO2/ Al2O3 n-MOSFET. Trap density has been scanned either in energy or in position based on charge-pumping (CP) measurements performed under different operating conditions in terms of amplitude and frequency of the gate pulse. Our results have revealed that the traps are meanly localized shallow in energy level, deeper in spatial position and they are mostly generated near the Si/SiO2 interface. (C) 2007 Elsevier Ltd. All rights reserved.