Ab Initio Molecular Dynamics Simulation of Microstructure and Transport Properties of K₃AlF₆-2.2NaF-AlF₃ System

Researching the aluminum molten salt system has always been challenging because of the high temperature and significant corrosion seen in the aluminum electrolysis industry. This paper employs ab initio molecular dynamics simulations to investigate the ionic structure and transport features of the K...

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Hlavní autoři:	Jingkun Wang, Can Chen, Hongliang Zhang, Jiaqi Li
Médium:	Artigo
Jazyk:	Inglês
Vydáno:	MDPI AG 2023-08-01
Edice:	Metals
Témata:	aluminum electrolysis K-rich salt aluminum electrolyte molecular dynamics simulation ion structure transport properties
On-line přístup:	https://www.mdpi.com/2075-4701/13/9/1521
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