Effect of substituting CaO with BaO on the viscosity and structure of CaO‐BaO‐SiO2‐MgO‐Al2O3 slags
In this study, the effect of CaO and BaO substitution on the viscosity and structure of CaO‐
BaO‐SiO2‐MgO‐Al2O3 slags was investigated. The results showed that the viscosity …
BaO‐SiO2‐MgO‐Al2O3 slags was investigated. The results showed that the viscosity …
Structural, vibrational, and elastic properties of a calcium aluminosilicate glass from molecular dynamics simulations: the role of the potential
M Bauchy - The Journal of chemical physics, 2014 - pubs.aip.org
We study a calcium aluminosilicate glass of composition (SiO 2) 0.60 (Al 2 O 3) 0.10 (CaO)
0.30 by means of molecular dynamics. To this end, we conduct parallel simulations …
0.30 by means of molecular dynamics. To this end, we conduct parallel simulations …
Molecular simulations of oxide and silicate melts and glasses
S Jahn - Reviews in Mineralogy and Geochemistry, 2022 - pubs.geoscienceworld.org
The last twenty-five years have seen a tremendous increase in computing power. It is
therefore not surprising that computer simulations of melts and glasses have become an …
therefore not surprising that computer simulations of melts and glasses have become an …
Atomic-molecular perspectives on local high-temperature structure and transport properties of CaCO3-foamed glass
Significant gaps remain in understanding of gas-melt interfaces in foamed glass systems.
We attempt to address these gaps by reporting on the transition of local structure, ionic …
We attempt to address these gaps by reporting on the transition of local structure, ionic …
Exploration of the amphoteric transition of Al2O3 on melt structure and viscosity of silicate slag
W Xuan, Y Zhang - Ceramics International, 2023 - Elsevier
The amphoteric oxide Al 2 O 3 has different behaviors in different chemical environments. In
an acidic environment, Al 3+ breaks the network structure while in an alkaline environment …
an acidic environment, Al 3+ breaks the network structure while in an alkaline environment …
Ring size distribution in silicate glasses revealed by neutron scattering first sharp diffraction peak analysis
Silicate glasses have no long range order and a short range order similar to their crystalline
counter-parts. Therefore, their key structurally distinct information lies in the medium range …
counter-parts. Therefore, their key structurally distinct information lies in the medium range …
Molecular dynamics study of the structural properties of calcium aluminosilicate slags with varying Al2O3/SiO2 ratios
K Zheng, Z Zhang, F Yang, S Sridhar - ISIJ international, 2012 - jstage.jst.go.jp
Molecular dynamics simulation was explored to investigate the change of structure of
calcium aluminosilicate slags with varying Al2O3/SiO2 ratios at a fixed CaO content. In …
calcium aluminosilicate slags with varying Al2O3/SiO2 ratios at a fixed CaO content. In …
Molecular dynamics simulation of the structure and properties for the CaO–SiO2 and CaO–Al2O3 systems
T Wu, S He, Y Liang, Q Wang - Journal of non-crystalline solids, 2015 - Elsevier
The microstructure and transport properties of CaO–SiO 2 and CaO–Al 2 O 3 systems were
studied by molecular dynamics simulations and the relations between the structure and …
studied by molecular dynamics simulations and the relations between the structure and …
Effects of the amphoteric behavior of Al2O3 on the structure and properties of CaO–SiO2–Al2O3 melts by molecular dynamics
Y Chen, W Pan, B Jia, Q Wang, X Zhang… - Journal of Non …, 2021 - Elsevier
Amphoteric oxide Al 2 O 3 is generally considered to be acidic or alkaline in different
environment. The effects of Al 2 O 3 on the structure and dynamic property of CaO–SiO 2–Al …
environment. The effects of Al 2 O 3 on the structure and dynamic property of CaO–SiO 2–Al …
Structural and dynamic properties of calcium aluminosilicate melts: a molecular dynamics study
M Bouhadja, N Jakse, A Pasturel - The Journal of chemical physics, 2013 - pubs.aip.org
The structural and dynamic properties of calcium aluminosilicate (CaO–Al 2 O 3) 1− x (SiO
2) x melts with low silica content, namely, along the concentration ratio R= 1 are studied by …
2) x melts with low silica content, namely, along the concentration ratio R= 1 are studied by …