Concepedia

NaZr<sub>2</sub>(PO<sub>4</sub>)<sub>3</sub> – a cubic langbeinite-type sodium-ion solid conductor

Sergey N. Marshenya, Alexey G. Scherbakov, Artem D. Dembitskiy, Alexander A. Golubnichiy, Ivan A. Trussov, Aleksandra A. Savina, Dmitry A. Aksyonov, Evgeny V. Antipov, Stanislav S. Fedotov

Dalton Transactions · 2024 · 10 citations · 53 references

DOI

Concepts

Abstract

The synthesis of a cubic langbeinite NaZr 2 (PO 4 ) 3 via an ion exchange reaction supported by mechanochemical activation is described. The crystal structure and Na transport properties are studied. HT XRD reveals negative thermal expansion.

References

53

Generalized Gradient Approximation Made Simple

John P. Perdew, Kieron Burke, Matthias Ernzerhof · Physical Review Letters · 1996 · 211.5K citations · Full text

, , +16

<i>Ab initio</i>molecular-dynamics simulation of the liquid-metal–amorphous-semiconductor transition in germanium

Georg Kresse, J. Häfner · Physical review. B, Condensed matter · 1994 · 22.7K citations

, , +17

Commentary: The Materials Project: A materials genome approach to accelerating materials innovation

Anubhav Jain, Shyue Ping Ong, Geoffroy Hautier et al. · APL Materials · 2013 · 12.7K citations · Full text

, , +17

<i>TOPAS</i> and <i>TOPAS-Academic</i>: an optimization program integrating computer algebra and crystallographic objects written in C++

Alan A. Coelho · Journal of Applied Crystallography · 2018 · 2.4K citations

, , +15

Fast Na+-ion transport in skeleton structures

John B. Goodenough, Hawoong Hong, J. A. Kafalas · Materials Research Bulletin · 1976 · 2.2K citations

, , +14