A new multipurpose thermodynamic database for oxide systems

E. Yazhenskikh, T. Jantzen, K. Hack, and M. Müller

ABSTRACT

A new thermodynamic database for oxides has been developed in order to perform calculations and predictions of equilibria for various scientific and industrial applications (slags, ashes, glasses, minerals, ceramics, refractories, etc.). The database containing all known phases (gas, stoichiometric compounds, solid and liquid solutions) for combinations of  27 different components provides proper descriptions for many different processes under varying conditions (temperature, pressure, overall composition) including interactions between materials and environments, and thus supports the development of new materials.

KEYWORDS:

thermodynamic assessment, CALPHAD modelling, database development, phase equilibria, oxide systems, associate model, calculations of thermodynamic properties.

DOI: 10.1134/S0235010619010237

Posted in electrochemistry, metallurgy, modelling.

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