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2014
Aufsatz in Buch
Titel

Molecular dynamics simulation of SiO2 and SiO2-CaO mixtures

Abstract
The thermophysical properties of molten slags were calculated using a molecular dynamics simulation based on the rigid-ion model. For SiO2 and SiO2-CaO mixtures, the local structure in the liquid state was determined and a rather good agreement was observed with available experimental data. Values of the density of single and binary systems were calculated within 10% of error compared to experimental data.
Author(s)
Jacob, A.
Gray-Weale, A.
Masset, P.J.
Hauptwerk
Molten Salts Chemistry and Technology
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DOI
10.1002/9781118448847.ch3d
Language
Englisch
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