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Título: ACTIVITIES DETERMINATION OF BINARY METALLIC SYSTEMS AND COMPUTATIONAL CALCULATION OF PHASE DIAGRAMS
Autor(es): JOAO PAULO VIANA DE LIMA
Colaborador(es): ROGERIO NAVARRO CORREIA DE SIQUEIRA - Orientador
Catalogação: 29/JAN/2026 Língua(s): PORTUGUESE - BRAZIL
Tipo: TEXT Subtipo: SENIOR PROJECT
Notas: [pt] Todos os dados constantes dos documentos são de inteira responsabilidade de seus autores. Os dados utilizados nas descrições dos documentos estão em conformidade com os sistemas da administração da PUC-Rio.
[en] All data contained in the documents are the sole responsibility of the authors. The data used in the descriptions of the documents are in conformity with the systems of the administration of PUC-Rio.
Referência(s): [pt] https://www.maxwell.vrac.puc-rio.br/projetosEspeciais/TFCs/consultas/conteudo.php?strSecao=resultado&nrSeq=75201@1
[en] https://www.maxwell.vrac.puc-rio.br/projetosEspeciais/TFCs/consultas/conteudo.php?strSecao=resultado&nrSeq=75201@2
DOI: https://doi.org/10.17771/PUCRio.acad.75201
Resumo:
This dissertation has the goal of showing the efficacy of an UNIQUAC inspired method to calculate activities in liquid binary systems and assess its suitability in solid binary systems. Literature data was used in optimizing objective functions to obtain reasonable binary parameters. The results were up to standard for liquid systems. The results of some solid systems were below expectations, namely the alloys Au-Cu, Cd-Mg and Fe-Mn. Besides comparing literature data with the theoretical calculations, the activities were utilized in an iterative method for solid-liquid equilibrium calculation in two binary systems: Cu-Ni and Bi-Sb. The calculations for the Cu-Ni systems were bad. On the other hand, the Bi-Sb showed good agreement with experimental data.
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