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  • About
  • The Global ETD Search service is a free service for researchers to find electronic theses and dissertations. This service is provided by the Networked Digital Library of Theses and Dissertations.
    Our metadata is collected from universities around the world. If you manage a university/consortium/country archive and want to be added, details can be found on the NDLTD website.
1

First-Principles calculations of Core-Level shifts in random metallic alloys: The Transition State Approach

Göransson (Asker), Christian January 2004 (has links)
<p>The overall aim of this thesis is to compare different methods for calculation of Core-Level shifts in metallic alloys. The methods compared are the Initial State model, the Complete screening and the Transition state model. Core-level shifts can give information of chemical bonding and about the electronic structure in solids.</p><p>The basic theory used is the so-called Density-Functional-Theory, in conjunction with the Local-Density Approximation and the Coherent-Potential- Approximation. The metallic alloys used are Silver-Palladium, Copper-Palladium, Copper-Gold and Copper-Platinum, all inface-centered-cubic configuration.</p><p>The complete screening- and the transition-state model are found to be in better agreement with experimental results than those calculated with the initial state model. This is mainly due to the fact that the two former models includes final-state effects, whereas the last one do not. The screening parameters within the Coherent-Potential approximation are also investigated. It is found that the Screened-Impurity Model can extend the validity of the Coherent-Potential-Approximation and increase it's accuracy.</p>
2

First-Principles calculations of Core-Level shifts in random metallic alloys: The Transition State Approach

Göransson (Asker), Christian January 2004 (has links)
The overall aim of this thesis is to compare different methods for calculation of Core-Level shifts in metallic alloys. The methods compared are the Initial State model, the Complete screening and the Transition state model. Core-level shifts can give information of chemical bonding and about the electronic structure in solids. The basic theory used is the so-called Density-Functional-Theory, in conjunction with the Local-Density Approximation and the Coherent-Potential- Approximation. The metallic alloys used are Silver-Palladium, Copper-Palladium, Copper-Gold and Copper-Platinum, all inface-centered-cubic configuration. The complete screening- and the transition-state model are found to be in better agreement with experimental results than those calculated with the initial state model. This is mainly due to the fact that the two former models includes final-state effects, whereas the last one do not. The screening parameters within the Coherent-Potential approximation are also investigated. It is found that the Screened-Impurity Model can extend the validity of the Coherent-Potential-Approximation and increase it's accuracy.
3

Caracterização do processo de fusão - fissão em sistemas nucleares / Characterization of the process of fusion - fission in nuclear systems

Anjos, Roberto Meigikos dos 29 September 1992 (has links)
Medidas das seções de choque de fusão, de processos fortemente amortecidos e de espalhamento elástico foram realizadas para os sistemas 16,17,18O + 10,11B e 19F + 9Be no intervalo de energia de bombardeio compreendido entre 22 ELAB64 Mev. São apresentadas evidências de que processos binários fortemente amortecidos observados nestes sistemas originam-se preferencialmente de um processo de fusão-fissão e não de um mecanismo de orbiting dinuclear. A importância relativa do processo de fusão-fissão nestes sistemas muito leves é comprovada pelos resultados experimentais, que indicam a ocorrência de um processo de fissão de um núcleo composto estatisticamente equilibrado, assim como por cálculos de modelos teóricos. Os números atômicos e os de massa dos produtos de reação e dos resíduos de evaporação foram identificados usando-se duas câmaras de ionização e um sistema de tempo de voo. / Cross sections for fusion, strongly energy-damped processes and elastic scattering were measured for the 16 ,17, 18O + 10 11B and 19F + 9Be systems in the energy range 22 ELAB 64 HeV. Evidence that the fully energy-damped binary products observed in these reactions originate from a fusion-fission process, rather than through a deep-inelastic orbiting mechanism, is presented. The relative importance of the fusion-fission process in these very light systems is supported by experimental results which points towards the fission of a statistically equilibrated compound nucleus and also by model calculations. Charges and masses of the reaction products and evaporation residues were indentified using two ionization chamber and a time-of-flight system.
4

Caracterização do processo de fusão - fissão em sistemas nucleares / Characterization of the process of fusion - fission in nuclear systems

Roberto Meigikos dos Anjos 29 September 1992 (has links)
Medidas das seções de choque de fusão, de processos fortemente amortecidos e de espalhamento elástico foram realizadas para os sistemas 16,17,18O + 10,11B e 19F + 9Be no intervalo de energia de bombardeio compreendido entre 22 ELAB64 Mev. São apresentadas evidências de que processos binários fortemente amortecidos observados nestes sistemas originam-se preferencialmente de um processo de fusão-fissão e não de um mecanismo de orbiting dinuclear. A importância relativa do processo de fusão-fissão nestes sistemas muito leves é comprovada pelos resultados experimentais, que indicam a ocorrência de um processo de fissão de um núcleo composto estatisticamente equilibrado, assim como por cálculos de modelos teóricos. Os números atômicos e os de massa dos produtos de reação e dos resíduos de evaporação foram identificados usando-se duas câmaras de ionização e um sistema de tempo de voo. / Cross sections for fusion, strongly energy-damped processes and elastic scattering were measured for the 16 ,17, 18O + 10 11B and 19F + 9Be systems in the energy range 22 ELAB 64 HeV. Evidence that the fully energy-damped binary products observed in these reactions originate from a fusion-fission process, rather than through a deep-inelastic orbiting mechanism, is presented. The relative importance of the fusion-fission process in these very light systems is supported by experimental results which points towards the fission of a statistically equilibrated compound nucleus and also by model calculations. Charges and masses of the reaction products and evaporation residues were indentified using two ionization chamber and a time-of-flight system.

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