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A New Superionic Plastic Polymorph of the Na+ Conductor Na3PS4

Famprikis, Theodosios ; Dawson, James A. ; Fauth, François ; Clemens, Oliver ; Suard, Emmanuelle ; Fleutot, Benoit ; Courty, Matthieu ; Chotard, Jean-Noël ; Islam, M. Saiful ; Masquelier, Christian (2019)
A New Superionic Plastic Polymorph of the Na+ Conductor Na3PS4.
In: ACS Materials Letters, 1 (6)
doi: 10.1021/acsmaterialslett.9b00322
Artikel, Bibliographie

Kurzbeschreibung (Abstract)

Na3PS4 is one of the most promising Na+ conductors, relevant for applications that can leverage its high ionic conductivity, such as solid-state batteries. Currently, two crystalline phases of the material have been identified, and it has been thought to melt above 500 °C. In contrast, based on diffraction, ab initio simulations, impedance spectroscopy, and thermal analysis, we show that Na3PS4 remains solid above this temperature and transforms to a third polymorph, γ, exhibiting fast-ion conduction and an orthorhombic crystal structure. We show that the fast Na+-conduction is associated with rotational motion of the thiophosphate polyanions pointing to a plastic crystal. These findings are of major importance for the development and understanding of new polyanion-based solid electrolytes.

Typ des Eintrags: Artikel
Erschienen: 2019
Autor(en): Famprikis, Theodosios ; Dawson, James A. ; Fauth, François ; Clemens, Oliver ; Suard, Emmanuelle ; Fleutot, Benoit ; Courty, Matthieu ; Chotard, Jean-Noël ; Islam, M. Saiful ; Masquelier, Christian
Art des Eintrags: Bibliographie
Titel: A New Superionic Plastic Polymorph of the Na+ Conductor Na3PS4
Sprache: Englisch
Publikationsjahr: 30 Oktober 2019
Verlag: American Chemical Society
Titel der Zeitschrift, Zeitung oder Schriftenreihe: ACS Materials Letters
Jahrgang/Volume einer Zeitschrift: 1
(Heft-)Nummer: 6
DOI: 10.1021/acsmaterialslett.9b00322
URL / URN: https://doi.org/10.1021/acsmaterialslett.9b00322
Kurzbeschreibung (Abstract):

Na3PS4 is one of the most promising Na+ conductors, relevant for applications that can leverage its high ionic conductivity, such as solid-state batteries. Currently, two crystalline phases of the material have been identified, and it has been thought to melt above 500 °C. In contrast, based on diffraction, ab initio simulations, impedance spectroscopy, and thermal analysis, we show that Na3PS4 remains solid above this temperature and transforms to a third polymorph, γ, exhibiting fast-ion conduction and an orthorhombic crystal structure. We show that the fast Na+-conduction is associated with rotational motion of the thiophosphate polyanions pointing to a plastic crystal. These findings are of major importance for the development and understanding of new polyanion-based solid electrolytes.

Freie Schlagworte: Plastics Thermodynamic modeling, Physical and chemical processes, Ionic conductivity, Phase transitions
Fachbereich(e)/-gebiet(e): 11 Fachbereich Material- und Geowissenschaften
11 Fachbereich Material- und Geowissenschaften > Materialwissenschaft
11 Fachbereich Material- und Geowissenschaften > Materialwissenschaft > Fachgebiet Materialdesign durch Synthese
Hinterlegungsdatum: 19 Feb 2020 07:31
Letzte Änderung: 19 Feb 2020 07:31
PPN:
Projekte: T.F. acknowledges the Alistore ERI and CNRS for their financial support in the form of a joint Ph.D. project between Amiens (France) and Bath (UK)., M.S.I. and J.A.D. acknowledge the EPSRC Programme Grant (No. EP/M009521/1) and the MCC-Archer consortium (No. EP/L000202/1).
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