Hybrid density functional theoretical study of NASICON-type NaxTi2(PO4)3 (x = 1

Hybrid density functional theoretical study of NASICON-type NaxTi2(PO4)3 (x = 1–4)

Published:2020 Issue:21 Volume:22 Page:11861-11870
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Gryaznov Denis¹²³⁴^ORCID,Stauffer Shannon K.¹²³⁴,Kotomin Eugene A.⁵⁶⁷⁸^ORCID,Vilčiauskas Linas¹²³⁴^ORCID

Affiliation:

1. Center for Physical Sciences and Technology (FTMC)

2. Saulėtekio al. 3

3. LT-10257 Vilnius

4. Lithuania

5. Institute of Solid State Physics

6. University of Latvia

7. LV-1063 Riga

8. Latvia

Abstract

Sodium Super Ionic Conductor (NASICON) structured Na_xTi₂(PO₄)₃ phosphate framework compounds represent a very attractive class of materials for their use as Na-ion battery electrodes.

Funder

European Regional Development Fund

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2020/CP/D0CP00772B

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