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The Structure of Soda-Lime-Silicate Glass and Melt by X-ray Diffraction Method (SOLID STATE CHEMISTRY-Amorphous Materials)

机译:X射线衍射法(固态化学非晶态材料)的钠钙硅酸盐玻璃和熔体的结构

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摘要

The structure of soda-lime-silicate(16Na2O・10CaO・74SiO2) glass and melt (~1500°C) was investigated by X-ray diffraction method in combination with molecular dynamics(MD) calculation. The short- and intermediate range structure of the glass was investigated as a function of temperature by using MD simulation. The experimental results clearly show that there is no distinct difference in structure between the present glass and melt. We also found from MD calculation that the linkage of Si-O network made of SiO4 tetrahedra shows similarities between glass and melt. It is also found that the first sharp diffraction peak(FSDP) associated with intermediate range structure is contributed from the correlation between Na+(or Ca2+) and SiO4 network.
机译:通过X射线衍射法结合分子动力学(MD)计算,研究了钠钙硅酸盐(16Na2O·10CaO·74SiO2)玻璃和熔体(〜1500°C)的结构。通过使用MD模拟,研究了玻璃的短程和中程结构与温度的关系。实验结果清楚地表明,本发明的玻璃和熔体之间在结构上没有明显的区别。从MD计算中我们还发现,由SiO 4四面体制成的Si-O网络的键合显示出玻璃和熔体之间的相似性。还发现与中程结构相关的第一尖锐衍射峰(FSDP)是由Na +(或Ca2 +)和SiO4网络之间的相关性引起的。

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