3 resultados para Método numérico de partículas

em Repositório Institucional da Universidade Estadual de São Paulo - UNESP


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The main goal of this work is to investigate the effects of a nonlinear cubic term inserted in the Schrödinger equation for one-dimensional potentials studied in Quantum Mechanics textbooks. Being the main tool the numerical analysis in a large number of works, the analysis of this effect by this term in the potential itself, in order to work with an analytical solution, can be considered something new. For the harmonic oscillator potential, the analysis was made from a numerical method, comparing the result with the known results in the literature. In the case of the infinite well potential and the step potential, hoping to work with an analytical solution, by construction we started with the known wavefunction for the linear case noting the effects in the other physical quantities. The coupling of the physical quantities involved in this work has yielded, besides many complications in the calculations, a series of conditions on the existence and validity of the solutions in regard to the system possible configurations

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The development of nanostructured materials have aroused great interest of the industries all over the country, since they enable the development of devices that can be used as gate insulators on silicon transistors, electrochromic devices, solid electrolyte oxygen sensors and as a photoluminescent materials . In this project, it is proposed to investigate the optical properties of CeO2 modified with rare earth Er processed in hydrothermal-microwave. The synthesis of one-dimensional nanostructures (1D) was measured from dilute aqueous solutions of acids and salts of starting reagents in the presence of chemical basis, after these aqueous solutions were processed on hydrothermal-microwave to particle growth. The particles obtained after processing were characterized by X-ray Diffraction, Rietveld Analysis and Raman Spectroscopy. The particle morphology was observed by scanning electron microscopy with field emission gun. The synthesis of 1D nanostructures are evaluated for different surfactants and starting precursors (ceria different salts), pH, temperature and pressure which can modify the morphology of the nanostructures. Combining laboratory experiments and theoretical calculations it was desired to understand the organization of the nanoparticles and their resulting structure. Strict control of chemical homogeneity, crystal structure, microstructure and interaction of the CeO2 cluster with different surfactants using the Hartree-Fock method, was intended to obtain properties compatible with their use in catalysts and optical devices. The use of mineralizer agent KOH and 8 minutes of processing time synthesis conditions were chosen to evaluate the effect of Er dopant. It has been proved that this doping with rare earth increases the photoluminescent properties of the compound obtained without change the structural and morphological propreties of ceria