25–28 Sept 2018
Schloss Schönbrunn
Europe/Vienna timezone
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APPLICATION OF CRYSTALLOGRAPHY TO THE THERMODYNAMIC MODELLING OF SILICO-FERRITE OF CALCIUM AND ALUMINUM

25 Sept 2018, 17:15
20m
Room 7 - Marie Antoinette (Schloss Schönbrunn)

Room 7 - Marie Antoinette

Schloss Schönbrunn

Schloss Schönbrunn, Apothekertrakt, Vienna
Oral Presentation Sintering Sintering

Speaker

Dr Reiko Murao (Nippon Steel & Sumitomo Metal Corporation)

Description

It is important to understand solid–liquid equilibrium of Al2O3-CaO-Fe2O3-SiO2 system to understand the sintering reaction, although the sintering reaction is a non-equilibrium and inhomogeneous. Phase equilibrium calculation of this system has some problems, such as thermodynamic models for some silico-ferrite of aluminum and calcium phases were not present.
Thermodynamic modeling of SFCA, Ca2(Fe,Ca,Al)6(Fe,Al,Si)6O20 was conducted in the framework of the Compound Energy Formalism (CEF). Preferred substitution of Al in tetrahedral cite was observed by Fe and Al *K*-edge X-ray absorption near edge structure. On considering crystallographic information in particular the charge compensation relation in the SFCA solution, the Ca8(Fe3+)20*Oct*(CaSi6+,FeFe6+,FeAl6+)3*paired*(CaSi6+)1*paired*(Fe3+,Al3+)20*Tet*O80 structure was considered as the SFCA solution model. By using this new model, SFCA single phase region can be well described in the phase diagram of the Ca4Si3O10–CaFe6O10–CaAl6O10 system.

Author

Dr Reiko Murao (Nippon Steel & Sumitomo Metal Corporation)

Co-authors

Prof. In-Ho Jung (Seoul National University) Prof. Masao Kimura (High Energy Accelerator Research Organization) Mr Takayuki Harano (Nippon Steel & Sumitomo Metal Corporation)

Presentation materials