Crystal structures and local environments of NASICON-type Na3FeV(PO4)3 and Na4FeV(PO4)3 positive electrode materials for Na-ion batteries
hal.structure.identifier | Laboratoire réactivité et chimie des solides - UMR CNRS 7314 UPJV [LRCS] | |
hal.structure.identifier | Institut de Chimie de la Matière Condensée de Bordeaux [ICMCB] | |
hal.structure.identifier | Tiamat Energy | |
dc.contributor.author | PARK, Sunkyu | |
hal.structure.identifier | Laboratoire réactivité et chimie des solides - UMR CNRS 7314 UPJV [LRCS] | |
hal.structure.identifier | Réseau sur le stockage électrochimique de l'énergie [RS2E] | |
dc.contributor.author | CHOTARD, Jean-Noël | |
hal.structure.identifier | Institut de Chimie de la Matière Condensée de Bordeaux [ICMCB] | |
hal.structure.identifier | Réseau sur le stockage électrochimique de l'énergie [RS2E] | |
dc.contributor.author | CARLIER, Dany | |
hal.structure.identifier | Tiamat Energy | |
dc.contributor.author | MOOG, Iona | |
hal.structure.identifier | Laboratoire réactivité et chimie des solides - UMR CNRS 7314 UPJV [LRCS] | |
dc.contributor.author | COURTY, Matthieu | |
hal.structure.identifier | Institut de Chimie de la Matière Condensée de Bordeaux [ICMCB] | |
dc.contributor.author | DUTTINE, Mathieu | |
hal.structure.identifier | ALBA Synchrotron light source [Barcelone] | |
dc.contributor.author | FAUTH, François | |
hal.structure.identifier | Réseau sur le stockage électrochimique de l'énergie [RS2E] | |
dc.contributor.author | IADECOLA, Antonella | |
hal.structure.identifier | Institut de Chimie de la Matière Condensée de Bordeaux [ICMCB] | |
hal.structure.identifier | Réseau sur le stockage électrochimique de l'énergie [RS2E] | |
dc.contributor.author | CROGUENNEC, Laurence | |
hal.structure.identifier | Laboratoire réactivité et chimie des solides - UMR CNRS 7314 UPJV [LRCS] | |
hal.structure.identifier | Réseau sur le stockage électrochimique de l'énergie [RS2E] | |
dc.contributor.author | MASQUELIER, Christian | |
dc.date.issued | 2021 | |
dc.identifier.issn | 0897-4756 | |
dc.description.abstractEn | In this work, we investigate the crystal chemistry of Fe/V-mixed NASICON Na 3 FeV(PO 4) 3 and Na 4 FeV(PO 4) 3 compositions structurally related to Na 3 V 2 (PO 4) 3 , a positive electrode for Naion batteries. To synthesize Na 4 FeV(PO 4) 3 , various synthesis routes (solid-state, sol-gel assisted, and electrochemical syntheses) were investigated. Direct syntheses resulted in forming a NASICON-type phase with the presence of NaFePO 4 and Na 3 PO 4 impurities. The successful preparation of pure Na 4 FeV(PO 4) 3 has been achieved by electrochemical sodiation of Na 3 FeV(PO 4) 3. Both synchrotron X-ray absorption and Mössbauer spectroscopies allowed probing the local V and Fe environments and their oxidation states in Na 3 FeV(PO 4) 3 and Na 4 FeV(PO 4) 3. Na 3 FeV(PO 4) 3 crystallizes in the space group C2/c (a = 15.1394(2) Å; b = 8.72550(12) Å; c = 21.6142(3) Å; β = 90.1744(9)°, and Z = 12), and it is isostructural to an ordered α-form of Na 3 M 2 (PO 4) 3 (M = Fe, V). It presents a superstructure due to Na + ordering, as confirmed with differential scanning calorimetry and in situ temperature X-ray diffraction. The electrochemically-sodiated Na 4 FeV(PO 4) 3 powder crystallizes in the space group R-3c (a = 8.94656(8) Å, c = 21.3054(3) Å, and Z = 6) within which the two sodium sites, Na(1) and Na(2), are almost fully occupied. Na 4 FeV(PO 4) 3 allows the electrochemical extraction of 2.76 Na + per formula unit within the voltage range of 1.3-4.3 V vs. Na + /Na through the Fe III/II , V IV/III , and V V/IV redox couples. This identifies an interesting material for Na-ion batteries. | |
dc.description.sponsorship | Spectromètre EXAFS Rapide pour Cinétiques Chimiques - ANR-10-EQPX-0045 | |
dc.description.sponsorship | Laboratory of excellency for electrochemical energy storage - ANR-10-LABX-0076 | |
dc.language.iso | en | |
dc.publisher | American Chemical Society | |
dc.title.en | Crystal structures and local environments of NASICON-type Na3FeV(PO4)3 and Na4FeV(PO4)3 positive electrode materials for Na-ion batteries | |
dc.type | Article de revue | |
dc.identifier.doi | 10.1021/acs.chemmater.1c01457 | |
dc.subject.hal | Chimie/Matériaux | |
dc.subject.hal | Chimie/Cristallographie | |
bordeaux.journal | Chemistry of Materials | |
bordeaux.page | 5355-5367 | |
bordeaux.volume | 33 | |
bordeaux.issue | 13 | |
bordeaux.peerReviewed | oui | |
hal.identifier | hal-03350982 | |
hal.version | 1 | |
hal.popular | non | |
hal.audience | Internationale | |
hal.origin.link | https://hal.archives-ouvertes.fr//hal-03350982v1 | |
bordeaux.COinS | ctx_ver=Z39.88-2004&rft_val_fmt=info:ofi/fmt:kev:mtx:journal&rft.jtitle=Chemistry%20of%20Materials&rft.date=2021&rft.volume=33&rft.issue=13&rft.spage=5355-5367&rft.epage=5355-5367&rft.eissn=0897-4756&rft.issn=0897-4756&rft.au=PARK,%20Sunkyu&CHOTARD,%20Jean-No%C3%ABl&CARLIER,%20Dany&MOOG,%20Iona&COURTY,%20Matthieu&rft.genre=article |
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