Crystal growth in oxide melts – From CALPHAD thermodynamic modeling to statistical prediction

Acta Materialia(2024)

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摘要
Using a thermodynamic database approach (CALPHAD), thermodynamic parameters of crystal growth of 31 stoichiometric and non-stoichiometric glasses are calculated. Together with these parameters, the measured growth rates, taken from both literature and in-house measurements, are interpreted in the framework of four interface-controlled growth models: normal, screw-dislocation, 2D growth and a combination of the latter two. A multiple linear regression model is used to explain the maximum crystal growth rate and viscosity at the liquidus temperature with the above growth mechanisms. This finding seems to reflect a general trend and can therefore be used to avoid unintentional devitrification phenomena or to derive their temperature-time range based on the sole knowledge of glass viscosity and liquidus temperature. In future research, it can also help to reduce the experimental workload required for the development of novel glasses and glass-ceramics.
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关键词
Glass-forming ability,Crystal growth,CALPHAD,Thermodynamic modeling,Statistics
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