Temperature Dependent Micro-Structure of KAlF4 from Solid to Molten States

In situ high temperature X-ray diffraction and Raman spectroscopy were used to investigate the temperature dependent micro-structure of KAlF4. Density functional theory was applied to simulate the structure of crystalline KAlF4 while a quantum chemistry ab initio simulation was performed to explore...

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Bibliographic Details
Main Authors: Nan Ma, Jinglin You, Liming Lu, Jian Wang, Songming Wan
Format: Article
Language:English
Published: MDPI AG 2018-09-01
Series:Materials
Subjects:
Online Access:http://www.mdpi.com/1996-1944/11/10/1846