Thermodynamic modelling of an Al(2)O(3)-MnO system using the ionic model


Autoria(s): FARINA, Alexandre Bellegard; BENEDUCE NETO, Flavio
Contribuinte(s)

UNIVERSIDADE DE SÃO PAULO

Data(s)

18/10/2012

18/10/2012

2009

Resumo

The thermodynamic assessment of an Al(2)O(3)-MnO pseudo-binary system has been carried out with the use of an ionic model. The use of the electro-neutrality principles in addition to the constitutive relations, between site fractions of the species on each sub-lattice, the thermodynamics descriptions of each solid phase has been determined to make possible the solubility description. Based on the thermodynamics descriptions of each phase in addition to thermo-chemical data obtained from the literature, the Gibbs energy functions were optimized for each phase of the Al(2)O(3)-MnO system with the support of PARROT(R) module from ThemoCalc(R) package. A thermodynamic database was obtained, in agreement with the thermo-chemical data extracted from the literature, to describe the Al(2)O(3)-MnO system including the solubility description of solid phases. (C) 2009 Elsevier Ltd. All rights reserved.

Identificador

CALPHAD-COMPUTER COUPLING OF PHASE DIAGRAMS AND THERMOCHEMISTRY, v.33, n.4, p.711-718, 2009

0364-5916

http://producao.usp.br/handle/BDPI/18814

10.1016/j.calphad.2009.09.003

http://dx.doi.org/10.1016/j.calphad.2009.09.003

Idioma(s)

eng

Publicador

PERGAMON-ELSEVIER SCIENCE LTD

Relação

Calphad-computer Coupling of Phase Diagrams and Thermochemistry

Direitos

restrictedAccess

Copyright PERGAMON-ELSEVIER SCIENCE LTD

Palavras-Chave #Thermodynamic modelling #ThermoCalc (R) #Optimization #Al(2)O(3)-MnO #SOLID-SOLUTIONS #PHASE-DIAGRAMS #OPTIMIZATION #MELTS #ALUMINATE #MNO-AL2O3 #Thermodynamics #Chemistry, Physical
Tipo

article

original article

publishedVersion