Understanding the benefits of Al 3+ -doping on NaSICONs explained through an out-of-the-scheme isovalent substitution of Fe 3+ in Na 3 Fe 2 (PO 4 ) 3 series
NaSICON fast-ionic conductors have been largely considered as a viable solution for the development of energy storage units. Chemical doping is a popular technique to improve their electrochemical performance, and the widely accepted criterion is an aliovalent substitution, to increase the cationic...
Ausführliche Beschreibung
Gespeichert in:
| Autor*in: |
Taveri, Gianmarco [verfasserIn] Güneren, Alper [verfasserIn] Barlog, Martin [verfasserIn] Hnatko, Miroslav [verfasserIn] Zhukova, Inga [verfasserIn] Netriova, Zuzana [verfasserIn] Šimon, Erik [verfasserIn] Mičušik, Matej [verfasserIn] Mikolášek, Miroslav [verfasserIn] Kaňková, Hana [verfasserIn] |
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| Format: |
E-Artikel |
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| Sprache: |
Englisch |
| Erschienen: |
2023 |
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| Schlagwörter: |
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| Übergeordnetes Werk: |
Enthalten in: Journal of power sources - New York, NY [u.a.] : Elsevier, 1976, 592 |
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| Übergeordnetes Werk: |
volume:592 |
| DOI / URN: |
10.1016/j.jpowsour.2023.233917 |
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| Katalog-ID: |
ELV066272289 |
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| 100 | 1 | |a Taveri, Gianmarco |e verfasserin |0 (orcid)0009-0002-2395-8329 |4 aut | |
| 245 | 1 | 0 | |a Understanding the benefits of Al 3+ -doping on NaSICONs explained through an out-of-the-scheme isovalent substitution of Fe 3+ in Na 3 Fe 2 (PO 4 ) 3 series |
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| 520 | |a NaSICON fast-ionic conductors have been largely considered as a viable solution for the development of energy storage units. Chemical doping is a popular technique to improve their electrochemical performance, and the widely accepted criterion is an aliovalent substitution, to increase the cationic density, and/or an isovalent substitution with larger species, to enlarge the bottleneck, as widely speculated for the LATP series. However, this study demonstrates through electrochemical impedance spectroscopy that the ionic conductivity of a Na3Fe2(PO4)3 NaSICON isovalently doped with smaller Al3+ ions to form a Na3AlxFe2-x(PO4)3 NaSICON series can be improved up to 4 times. We resorted to X-ray diffraction and ab initio simulation to show that the NaSICON bottlenecks are enlarged despite the lattice shrinkage and the long-range diffusion path is unlocked for x ≥ 0.5. Moreover, the Al-doping sizeably increases the cohesive energy of the monoclinic lattice, thus stabilizing it. As a result, the cyclic voltammetry and galvanostatic charge-discharge tests of the half-cell battery with Na3AlxFe2-x(PO4)3 as the composite cathode showed better capacity and no decay. We believe that this out-of-the-scheme work will clarify the effects of Al-doping on NaSICON compounds and at the same time contribute to reviving the interest around this highly-sustainable Fe3+-based NaSICON. | ||
| 650 | 4 | |a NaSICON | |
| 650 | 4 | |a Aluminum doping | |
| 650 | 4 | |a Electrochemical performance | |
| 650 | 4 | |a Crystallographic analysis | |
| 650 | 4 | |a Ab-initio simulation | |
| 650 | 4 | |a Bottleneck | |
| 700 | 1 | |a Güneren, Alper |e verfasserin |0 (orcid)0000-0001-6841-4339 |4 aut | |
| 700 | 1 | |a Barlog, Martin |e verfasserin |0 (orcid)0000-0003-0452-1084 |4 aut | |
| 700 | 1 | |a Hnatko, Miroslav |e verfasserin |4 aut | |
| 700 | 1 | |a Zhukova, Inga |e verfasserin |4 aut | |
| 700 | 1 | |a Netriova, Zuzana |e verfasserin |4 aut | |
| 700 | 1 | |a Šimon, Erik |e verfasserin |0 (orcid)0000-0001-5019-8113 |4 aut | |
| 700 | 1 | |a Mičušik, Matej |e verfasserin |4 aut | |
| 700 | 1 | |a Mikolášek, Miroslav |e verfasserin |0 (orcid)0000-0002-0120-6823 |4 aut | |
| 700 | 1 | |a Kaňková, Hana |e verfasserin |0 (orcid)0000-0001-5494-9754 |4 aut | |
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10.1016/j.jpowsour.2023.233917 doi (DE-627)ELV066272289 (ELSEVIER)S0378-7753(23)01293-4 DE-627 ger DE-627 rda eng 620 VZ 52.57 bkl 53.36 bkl Taveri, Gianmarco verfasserin (orcid)0009-0002-2395-8329 aut Understanding the benefits of Al 3+ -doping on NaSICONs explained through an out-of-the-scheme isovalent substitution of Fe 3+ in Na 3 Fe 2 (PO 4 ) 3 series 2023 nicht spezifiziert zzz rdacontent Computermedien c rdamedia Online-Ressource cr rdacarrier NaSICON fast-ionic conductors have been largely considered as a viable solution for the development of energy storage units. Chemical doping is a popular technique to improve their electrochemical performance, and the widely accepted criterion is an aliovalent substitution, to increase the cationic density, and/or an isovalent substitution with larger species, to enlarge the bottleneck, as widely speculated for the LATP series. However, this study demonstrates through electrochemical impedance spectroscopy that the ionic conductivity of a Na3Fe2(PO4)3 NaSICON isovalently doped with smaller Al3+ ions to form a Na3AlxFe2-x(PO4)3 NaSICON series can be improved up to 4 times. We resorted to X-ray diffraction and ab initio simulation to show that the NaSICON bottlenecks are enlarged despite the lattice shrinkage and the long-range diffusion path is unlocked for x ≥ 0.5. Moreover, the Al-doping sizeably increases the cohesive energy of the monoclinic lattice, thus stabilizing it. As a result, the cyclic voltammetry and galvanostatic charge-discharge tests of the half-cell battery with Na3AlxFe2-x(PO4)3 as the composite cathode showed better capacity and no decay. We believe that this out-of-the-scheme work will clarify the effects of Al-doping on NaSICON compounds and at the same time contribute to reviving the interest around this highly-sustainable Fe3+-based NaSICON. NaSICON Aluminum doping Electrochemical performance Crystallographic analysis Ab-initio simulation Bottleneck Güneren, Alper verfasserin (orcid)0000-0001-6841-4339 aut Barlog, Martin verfasserin (orcid)0000-0003-0452-1084 aut Hnatko, Miroslav verfasserin aut Zhukova, Inga verfasserin aut Netriova, Zuzana verfasserin aut Šimon, Erik verfasserin (orcid)0000-0001-5019-8113 aut Mičušik, Matej verfasserin aut Mikolášek, Miroslav verfasserin (orcid)0000-0002-0120-6823 aut Kaňková, Hana verfasserin (orcid)0000-0001-5494-9754 aut Enthalten in Journal of power sources New York, NY [u.a.] : Elsevier, 1976 592 Online-Ressource (DE-627)302718923 (DE-600)1491915-1 (DE-576)259483958 1873-2755 nnns volume:592 GBV_USEFLAG_U GBV_ELV SYSFLAG_U GBV_ILN_20 GBV_ILN_22 GBV_ILN_23 GBV_ILN_24 GBV_ILN_31 GBV_ILN_32 GBV_ILN_40 GBV_ILN_60 GBV_ILN_62 GBV_ILN_65 GBV_ILN_69 GBV_ILN_70 GBV_ILN_73 GBV_ILN_74 GBV_ILN_90 GBV_ILN_95 GBV_ILN_100 GBV_ILN_105 GBV_ILN_110 GBV_ILN_150 GBV_ILN_151 GBV_ILN_187 GBV_ILN_213 GBV_ILN_224 GBV_ILN_230 GBV_ILN_370 GBV_ILN_602 GBV_ILN_702 GBV_ILN_2001 GBV_ILN_2003 GBV_ILN_2004 GBV_ILN_2005 GBV_ILN_2007 GBV_ILN_2008 GBV_ILN_2009 GBV_ILN_2010 GBV_ILN_2011 GBV_ILN_2014 GBV_ILN_2015 GBV_ILN_2020 GBV_ILN_2021 GBV_ILN_2025 GBV_ILN_2026 GBV_ILN_2027 GBV_ILN_2034 GBV_ILN_2044 GBV_ILN_2048 GBV_ILN_2049 GBV_ILN_2050 GBV_ILN_2055 GBV_ILN_2056 GBV_ILN_2059 GBV_ILN_2061 GBV_ILN_2064 GBV_ILN_2088 GBV_ILN_2106 GBV_ILN_2110 GBV_ILN_2111 GBV_ILN_2112 GBV_ILN_2122 GBV_ILN_2129 GBV_ILN_2143 GBV_ILN_2152 GBV_ILN_2153 GBV_ILN_2190 GBV_ILN_2232 GBV_ILN_2336 GBV_ILN_2470 GBV_ILN_2507 GBV_ILN_4035 GBV_ILN_4037 GBV_ILN_4112 GBV_ILN_4125 GBV_ILN_4242 GBV_ILN_4249 GBV_ILN_4251 GBV_ILN_4305 GBV_ILN_4306 GBV_ILN_4307 GBV_ILN_4313 GBV_ILN_4322 GBV_ILN_4323 GBV_ILN_4324 GBV_ILN_4325 GBV_ILN_4326 GBV_ILN_4333 GBV_ILN_4334 GBV_ILN_4338 GBV_ILN_4393 GBV_ILN_4700 52.57 Energiespeicherung VZ 53.36 Energiedirektumwandler elektrische Energiespeicher VZ AR 592 |
| spelling |
10.1016/j.jpowsour.2023.233917 doi (DE-627)ELV066272289 (ELSEVIER)S0378-7753(23)01293-4 DE-627 ger DE-627 rda eng 620 VZ 52.57 bkl 53.36 bkl Taveri, Gianmarco verfasserin (orcid)0009-0002-2395-8329 aut Understanding the benefits of Al 3+ -doping on NaSICONs explained through an out-of-the-scheme isovalent substitution of Fe 3+ in Na 3 Fe 2 (PO 4 ) 3 series 2023 nicht spezifiziert zzz rdacontent Computermedien c rdamedia Online-Ressource cr rdacarrier NaSICON fast-ionic conductors have been largely considered as a viable solution for the development of energy storage units. Chemical doping is a popular technique to improve their electrochemical performance, and the widely accepted criterion is an aliovalent substitution, to increase the cationic density, and/or an isovalent substitution with larger species, to enlarge the bottleneck, as widely speculated for the LATP series. However, this study demonstrates through electrochemical impedance spectroscopy that the ionic conductivity of a Na3Fe2(PO4)3 NaSICON isovalently doped with smaller Al3+ ions to form a Na3AlxFe2-x(PO4)3 NaSICON series can be improved up to 4 times. We resorted to X-ray diffraction and ab initio simulation to show that the NaSICON bottlenecks are enlarged despite the lattice shrinkage and the long-range diffusion path is unlocked for x ≥ 0.5. Moreover, the Al-doping sizeably increases the cohesive energy of the monoclinic lattice, thus stabilizing it. As a result, the cyclic voltammetry and galvanostatic charge-discharge tests of the half-cell battery with Na3AlxFe2-x(PO4)3 as the composite cathode showed better capacity and no decay. We believe that this out-of-the-scheme work will clarify the effects of Al-doping on NaSICON compounds and at the same time contribute to reviving the interest around this highly-sustainable Fe3+-based NaSICON. NaSICON Aluminum doping Electrochemical performance Crystallographic analysis Ab-initio simulation Bottleneck Güneren, Alper verfasserin (orcid)0000-0001-6841-4339 aut Barlog, Martin verfasserin (orcid)0000-0003-0452-1084 aut Hnatko, Miroslav verfasserin aut Zhukova, Inga verfasserin aut Netriova, Zuzana verfasserin aut Šimon, Erik verfasserin (orcid)0000-0001-5019-8113 aut Mičušik, Matej verfasserin aut Mikolášek, Miroslav verfasserin (orcid)0000-0002-0120-6823 aut Kaňková, Hana verfasserin (orcid)0000-0001-5494-9754 aut Enthalten in Journal of power sources New York, NY [u.a.] : Elsevier, 1976 592 Online-Ressource (DE-627)302718923 (DE-600)1491915-1 (DE-576)259483958 1873-2755 nnns volume:592 GBV_USEFLAG_U GBV_ELV SYSFLAG_U GBV_ILN_20 GBV_ILN_22 GBV_ILN_23 GBV_ILN_24 GBV_ILN_31 GBV_ILN_32 GBV_ILN_40 GBV_ILN_60 GBV_ILN_62 GBV_ILN_65 GBV_ILN_69 GBV_ILN_70 GBV_ILN_73 GBV_ILN_74 GBV_ILN_90 GBV_ILN_95 GBV_ILN_100 GBV_ILN_105 GBV_ILN_110 GBV_ILN_150 GBV_ILN_151 GBV_ILN_187 GBV_ILN_213 GBV_ILN_224 GBV_ILN_230 GBV_ILN_370 GBV_ILN_602 GBV_ILN_702 GBV_ILN_2001 GBV_ILN_2003 GBV_ILN_2004 GBV_ILN_2005 GBV_ILN_2007 GBV_ILN_2008 GBV_ILN_2009 GBV_ILN_2010 GBV_ILN_2011 GBV_ILN_2014 GBV_ILN_2015 GBV_ILN_2020 GBV_ILN_2021 GBV_ILN_2025 GBV_ILN_2026 GBV_ILN_2027 GBV_ILN_2034 GBV_ILN_2044 GBV_ILN_2048 GBV_ILN_2049 GBV_ILN_2050 GBV_ILN_2055 GBV_ILN_2056 GBV_ILN_2059 GBV_ILN_2061 GBV_ILN_2064 GBV_ILN_2088 GBV_ILN_2106 GBV_ILN_2110 GBV_ILN_2111 GBV_ILN_2112 GBV_ILN_2122 GBV_ILN_2129 GBV_ILN_2143 GBV_ILN_2152 GBV_ILN_2153 GBV_ILN_2190 GBV_ILN_2232 GBV_ILN_2336 GBV_ILN_2470 GBV_ILN_2507 GBV_ILN_4035 GBV_ILN_4037 GBV_ILN_4112 GBV_ILN_4125 GBV_ILN_4242 GBV_ILN_4249 GBV_ILN_4251 GBV_ILN_4305 GBV_ILN_4306 GBV_ILN_4307 GBV_ILN_4313 GBV_ILN_4322 GBV_ILN_4323 GBV_ILN_4324 GBV_ILN_4325 GBV_ILN_4326 GBV_ILN_4333 GBV_ILN_4334 GBV_ILN_4338 GBV_ILN_4393 GBV_ILN_4700 52.57 Energiespeicherung VZ 53.36 Energiedirektumwandler elektrische Energiespeicher VZ AR 592 |
| allfields_unstemmed |
10.1016/j.jpowsour.2023.233917 doi (DE-627)ELV066272289 (ELSEVIER)S0378-7753(23)01293-4 DE-627 ger DE-627 rda eng 620 VZ 52.57 bkl 53.36 bkl Taveri, Gianmarco verfasserin (orcid)0009-0002-2395-8329 aut Understanding the benefits of Al 3+ -doping on NaSICONs explained through an out-of-the-scheme isovalent substitution of Fe 3+ in Na 3 Fe 2 (PO 4 ) 3 series 2023 nicht spezifiziert zzz rdacontent Computermedien c rdamedia Online-Ressource cr rdacarrier NaSICON fast-ionic conductors have been largely considered as a viable solution for the development of energy storage units. Chemical doping is a popular technique to improve their electrochemical performance, and the widely accepted criterion is an aliovalent substitution, to increase the cationic density, and/or an isovalent substitution with larger species, to enlarge the bottleneck, as widely speculated for the LATP series. However, this study demonstrates through electrochemical impedance spectroscopy that the ionic conductivity of a Na3Fe2(PO4)3 NaSICON isovalently doped with smaller Al3+ ions to form a Na3AlxFe2-x(PO4)3 NaSICON series can be improved up to 4 times. We resorted to X-ray diffraction and ab initio simulation to show that the NaSICON bottlenecks are enlarged despite the lattice shrinkage and the long-range diffusion path is unlocked for x ≥ 0.5. Moreover, the Al-doping sizeably increases the cohesive energy of the monoclinic lattice, thus stabilizing it. As a result, the cyclic voltammetry and galvanostatic charge-discharge tests of the half-cell battery with Na3AlxFe2-x(PO4)3 as the composite cathode showed better capacity and no decay. We believe that this out-of-the-scheme work will clarify the effects of Al-doping on NaSICON compounds and at the same time contribute to reviving the interest around this highly-sustainable Fe3+-based NaSICON. NaSICON Aluminum doping Electrochemical performance Crystallographic analysis Ab-initio simulation Bottleneck Güneren, Alper verfasserin (orcid)0000-0001-6841-4339 aut Barlog, Martin verfasserin (orcid)0000-0003-0452-1084 aut Hnatko, Miroslav verfasserin aut Zhukova, Inga verfasserin aut Netriova, Zuzana verfasserin aut Šimon, Erik verfasserin (orcid)0000-0001-5019-8113 aut Mičušik, Matej verfasserin aut Mikolášek, Miroslav verfasserin (orcid)0000-0002-0120-6823 aut Kaňková, Hana verfasserin (orcid)0000-0001-5494-9754 aut Enthalten in Journal of power sources New York, NY [u.a.] : Elsevier, 1976 592 Online-Ressource (DE-627)302718923 (DE-600)1491915-1 (DE-576)259483958 1873-2755 nnns volume:592 GBV_USEFLAG_U GBV_ELV SYSFLAG_U GBV_ILN_20 GBV_ILN_22 GBV_ILN_23 GBV_ILN_24 GBV_ILN_31 GBV_ILN_32 GBV_ILN_40 GBV_ILN_60 GBV_ILN_62 GBV_ILN_65 GBV_ILN_69 GBV_ILN_70 GBV_ILN_73 GBV_ILN_74 GBV_ILN_90 GBV_ILN_95 GBV_ILN_100 GBV_ILN_105 GBV_ILN_110 GBV_ILN_150 GBV_ILN_151 GBV_ILN_187 GBV_ILN_213 GBV_ILN_224 GBV_ILN_230 GBV_ILN_370 GBV_ILN_602 GBV_ILN_702 GBV_ILN_2001 GBV_ILN_2003 GBV_ILN_2004 GBV_ILN_2005 GBV_ILN_2007 GBV_ILN_2008 GBV_ILN_2009 GBV_ILN_2010 GBV_ILN_2011 GBV_ILN_2014 GBV_ILN_2015 GBV_ILN_2020 GBV_ILN_2021 GBV_ILN_2025 GBV_ILN_2026 GBV_ILN_2027 GBV_ILN_2034 GBV_ILN_2044 GBV_ILN_2048 GBV_ILN_2049 GBV_ILN_2050 GBV_ILN_2055 GBV_ILN_2056 GBV_ILN_2059 GBV_ILN_2061 GBV_ILN_2064 GBV_ILN_2088 GBV_ILN_2106 GBV_ILN_2110 GBV_ILN_2111 GBV_ILN_2112 GBV_ILN_2122 GBV_ILN_2129 GBV_ILN_2143 GBV_ILN_2152 GBV_ILN_2153 GBV_ILN_2190 GBV_ILN_2232 GBV_ILN_2336 GBV_ILN_2470 GBV_ILN_2507 GBV_ILN_4035 GBV_ILN_4037 GBV_ILN_4112 GBV_ILN_4125 GBV_ILN_4242 GBV_ILN_4249 GBV_ILN_4251 GBV_ILN_4305 GBV_ILN_4306 GBV_ILN_4307 GBV_ILN_4313 GBV_ILN_4322 GBV_ILN_4323 GBV_ILN_4324 GBV_ILN_4325 GBV_ILN_4326 GBV_ILN_4333 GBV_ILN_4334 GBV_ILN_4338 GBV_ILN_4393 GBV_ILN_4700 52.57 Energiespeicherung VZ 53.36 Energiedirektumwandler elektrische Energiespeicher VZ AR 592 |
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10.1016/j.jpowsour.2023.233917 doi (DE-627)ELV066272289 (ELSEVIER)S0378-7753(23)01293-4 DE-627 ger DE-627 rda eng 620 VZ 52.57 bkl 53.36 bkl Taveri, Gianmarco verfasserin (orcid)0009-0002-2395-8329 aut Understanding the benefits of Al 3+ -doping on NaSICONs explained through an out-of-the-scheme isovalent substitution of Fe 3+ in Na 3 Fe 2 (PO 4 ) 3 series 2023 nicht spezifiziert zzz rdacontent Computermedien c rdamedia Online-Ressource cr rdacarrier NaSICON fast-ionic conductors have been largely considered as a viable solution for the development of energy storage units. Chemical doping is a popular technique to improve their electrochemical performance, and the widely accepted criterion is an aliovalent substitution, to increase the cationic density, and/or an isovalent substitution with larger species, to enlarge the bottleneck, as widely speculated for the LATP series. However, this study demonstrates through electrochemical impedance spectroscopy that the ionic conductivity of a Na3Fe2(PO4)3 NaSICON isovalently doped with smaller Al3+ ions to form a Na3AlxFe2-x(PO4)3 NaSICON series can be improved up to 4 times. We resorted to X-ray diffraction and ab initio simulation to show that the NaSICON bottlenecks are enlarged despite the lattice shrinkage and the long-range diffusion path is unlocked for x ≥ 0.5. Moreover, the Al-doping sizeably increases the cohesive energy of the monoclinic lattice, thus stabilizing it. As a result, the cyclic voltammetry and galvanostatic charge-discharge tests of the half-cell battery with Na3AlxFe2-x(PO4)3 as the composite cathode showed better capacity and no decay. We believe that this out-of-the-scheme work will clarify the effects of Al-doping on NaSICON compounds and at the same time contribute to reviving the interest around this highly-sustainable Fe3+-based NaSICON. NaSICON Aluminum doping Electrochemical performance Crystallographic analysis Ab-initio simulation Bottleneck Güneren, Alper verfasserin (orcid)0000-0001-6841-4339 aut Barlog, Martin verfasserin (orcid)0000-0003-0452-1084 aut Hnatko, Miroslav verfasserin aut Zhukova, Inga verfasserin aut Netriova, Zuzana verfasserin aut Šimon, Erik verfasserin (orcid)0000-0001-5019-8113 aut Mičušik, Matej verfasserin aut Mikolášek, Miroslav verfasserin (orcid)0000-0002-0120-6823 aut Kaňková, Hana verfasserin (orcid)0000-0001-5494-9754 aut Enthalten in Journal of power sources New York, NY [u.a.] : Elsevier, 1976 592 Online-Ressource (DE-627)302718923 (DE-600)1491915-1 (DE-576)259483958 1873-2755 nnns volume:592 GBV_USEFLAG_U GBV_ELV SYSFLAG_U GBV_ILN_20 GBV_ILN_22 GBV_ILN_23 GBV_ILN_24 GBV_ILN_31 GBV_ILN_32 GBV_ILN_40 GBV_ILN_60 GBV_ILN_62 GBV_ILN_65 GBV_ILN_69 GBV_ILN_70 GBV_ILN_73 GBV_ILN_74 GBV_ILN_90 GBV_ILN_95 GBV_ILN_100 GBV_ILN_105 GBV_ILN_110 GBV_ILN_150 GBV_ILN_151 GBV_ILN_187 GBV_ILN_213 GBV_ILN_224 GBV_ILN_230 GBV_ILN_370 GBV_ILN_602 GBV_ILN_702 GBV_ILN_2001 GBV_ILN_2003 GBV_ILN_2004 GBV_ILN_2005 GBV_ILN_2007 GBV_ILN_2008 GBV_ILN_2009 GBV_ILN_2010 GBV_ILN_2011 GBV_ILN_2014 GBV_ILN_2015 GBV_ILN_2020 GBV_ILN_2021 GBV_ILN_2025 GBV_ILN_2026 GBV_ILN_2027 GBV_ILN_2034 GBV_ILN_2044 GBV_ILN_2048 GBV_ILN_2049 GBV_ILN_2050 GBV_ILN_2055 GBV_ILN_2056 GBV_ILN_2059 GBV_ILN_2061 GBV_ILN_2064 GBV_ILN_2088 GBV_ILN_2106 GBV_ILN_2110 GBV_ILN_2111 GBV_ILN_2112 GBV_ILN_2122 GBV_ILN_2129 GBV_ILN_2143 GBV_ILN_2152 GBV_ILN_2153 GBV_ILN_2190 GBV_ILN_2232 GBV_ILN_2336 GBV_ILN_2470 GBV_ILN_2507 GBV_ILN_4035 GBV_ILN_4037 GBV_ILN_4112 GBV_ILN_4125 GBV_ILN_4242 GBV_ILN_4249 GBV_ILN_4251 GBV_ILN_4305 GBV_ILN_4306 GBV_ILN_4307 GBV_ILN_4313 GBV_ILN_4322 GBV_ILN_4323 GBV_ILN_4324 GBV_ILN_4325 GBV_ILN_4326 GBV_ILN_4333 GBV_ILN_4334 GBV_ILN_4338 GBV_ILN_4393 GBV_ILN_4700 52.57 Energiespeicherung VZ 53.36 Energiedirektumwandler elektrische Energiespeicher VZ AR 592 |
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10.1016/j.jpowsour.2023.233917 doi (DE-627)ELV066272289 (ELSEVIER)S0378-7753(23)01293-4 DE-627 ger DE-627 rda eng 620 VZ 52.57 bkl 53.36 bkl Taveri, Gianmarco verfasserin (orcid)0009-0002-2395-8329 aut Understanding the benefits of Al 3+ -doping on NaSICONs explained through an out-of-the-scheme isovalent substitution of Fe 3+ in Na 3 Fe 2 (PO 4 ) 3 series 2023 nicht spezifiziert zzz rdacontent Computermedien c rdamedia Online-Ressource cr rdacarrier NaSICON fast-ionic conductors have been largely considered as a viable solution for the development of energy storage units. Chemical doping is a popular technique to improve their electrochemical performance, and the widely accepted criterion is an aliovalent substitution, to increase the cationic density, and/or an isovalent substitution with larger species, to enlarge the bottleneck, as widely speculated for the LATP series. However, this study demonstrates through electrochemical impedance spectroscopy that the ionic conductivity of a Na3Fe2(PO4)3 NaSICON isovalently doped with smaller Al3+ ions to form a Na3AlxFe2-x(PO4)3 NaSICON series can be improved up to 4 times. We resorted to X-ray diffraction and ab initio simulation to show that the NaSICON bottlenecks are enlarged despite the lattice shrinkage and the long-range diffusion path is unlocked for x ≥ 0.5. Moreover, the Al-doping sizeably increases the cohesive energy of the monoclinic lattice, thus stabilizing it. As a result, the cyclic voltammetry and galvanostatic charge-discharge tests of the half-cell battery with Na3AlxFe2-x(PO4)3 as the composite cathode showed better capacity and no decay. We believe that this out-of-the-scheme work will clarify the effects of Al-doping on NaSICON compounds and at the same time contribute to reviving the interest around this highly-sustainable Fe3+-based NaSICON. NaSICON Aluminum doping Electrochemical performance Crystallographic analysis Ab-initio simulation Bottleneck Güneren, Alper verfasserin (orcid)0000-0001-6841-4339 aut Barlog, Martin verfasserin (orcid)0000-0003-0452-1084 aut Hnatko, Miroslav verfasserin aut Zhukova, Inga verfasserin aut Netriova, Zuzana verfasserin aut Šimon, Erik verfasserin (orcid)0000-0001-5019-8113 aut Mičušik, Matej verfasserin aut Mikolášek, Miroslav verfasserin (orcid)0000-0002-0120-6823 aut Kaňková, Hana verfasserin (orcid)0000-0001-5494-9754 aut Enthalten in Journal of power sources New York, NY [u.a.] : Elsevier, 1976 592 Online-Ressource (DE-627)302718923 (DE-600)1491915-1 (DE-576)259483958 1873-2755 nnns volume:592 GBV_USEFLAG_U GBV_ELV SYSFLAG_U GBV_ILN_20 GBV_ILN_22 GBV_ILN_23 GBV_ILN_24 GBV_ILN_31 GBV_ILN_32 GBV_ILN_40 GBV_ILN_60 GBV_ILN_62 GBV_ILN_65 GBV_ILN_69 GBV_ILN_70 GBV_ILN_73 GBV_ILN_74 GBV_ILN_90 GBV_ILN_95 GBV_ILN_100 GBV_ILN_105 GBV_ILN_110 GBV_ILN_150 GBV_ILN_151 GBV_ILN_187 GBV_ILN_213 GBV_ILN_224 GBV_ILN_230 GBV_ILN_370 GBV_ILN_602 GBV_ILN_702 GBV_ILN_2001 GBV_ILN_2003 GBV_ILN_2004 GBV_ILN_2005 GBV_ILN_2007 GBV_ILN_2008 GBV_ILN_2009 GBV_ILN_2010 GBV_ILN_2011 GBV_ILN_2014 GBV_ILN_2015 GBV_ILN_2020 GBV_ILN_2021 GBV_ILN_2025 GBV_ILN_2026 GBV_ILN_2027 GBV_ILN_2034 GBV_ILN_2044 GBV_ILN_2048 GBV_ILN_2049 GBV_ILN_2050 GBV_ILN_2055 GBV_ILN_2056 GBV_ILN_2059 GBV_ILN_2061 GBV_ILN_2064 GBV_ILN_2088 GBV_ILN_2106 GBV_ILN_2110 GBV_ILN_2111 GBV_ILN_2112 GBV_ILN_2122 GBV_ILN_2129 GBV_ILN_2143 GBV_ILN_2152 GBV_ILN_2153 GBV_ILN_2190 GBV_ILN_2232 GBV_ILN_2336 GBV_ILN_2470 GBV_ILN_2507 GBV_ILN_4035 GBV_ILN_4037 GBV_ILN_4112 GBV_ILN_4125 GBV_ILN_4242 GBV_ILN_4249 GBV_ILN_4251 GBV_ILN_4305 GBV_ILN_4306 GBV_ILN_4307 GBV_ILN_4313 GBV_ILN_4322 GBV_ILN_4323 GBV_ILN_4324 GBV_ILN_4325 GBV_ILN_4326 GBV_ILN_4333 GBV_ILN_4334 GBV_ILN_4338 GBV_ILN_4393 GBV_ILN_4700 52.57 Energiespeicherung VZ 53.36 Energiedirektumwandler elektrische Energiespeicher VZ AR 592 |
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Enthalten in Journal of power sources 592 volume:592 |
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Energiespeicherung Energiedirektumwandler elektrische Energiespeicher |
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NaSICON Aluminum doping Electrochemical performance Crystallographic analysis Ab-initio simulation Bottleneck |
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Taveri, Gianmarco @@aut@@ Güneren, Alper @@aut@@ Barlog, Martin @@aut@@ Hnatko, Miroslav @@aut@@ Zhukova, Inga @@aut@@ Netriova, Zuzana @@aut@@ Šimon, Erik @@aut@@ Mičušik, Matej @@aut@@ Mikolášek, Miroslav @@aut@@ Kaňková, Hana @@aut@@ |
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2023-01-01T00:00:00Z |
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Taveri, Gianmarco |
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Taveri, Gianmarco ddc 620 bkl 52.57 bkl 53.36 misc NaSICON misc Aluminum doping misc Electrochemical performance misc Crystallographic analysis misc Ab-initio simulation misc Bottleneck Understanding the benefits of Al 3+ -doping on NaSICONs explained through an out-of-the-scheme isovalent substitution of Fe 3+ in Na 3 Fe 2 (PO 4 ) 3 series |
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620 VZ 52.57 bkl 53.36 bkl Understanding the benefits of Al 3+ -doping on NaSICONs explained through an out-of-the-scheme isovalent substitution of Fe 3+ in Na 3 Fe 2 (PO 4 ) 3 series NaSICON Aluminum doping Electrochemical performance Crystallographic analysis Ab-initio simulation Bottleneck |
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Understanding the benefits of Al 3+ -doping on NaSICONs explained through an out-of-the-scheme isovalent substitution of Fe 3+ in Na 3 Fe 2 (PO 4 ) 3 series |
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Understanding the benefits of Al 3+ -doping on NaSICONs explained through an out-of-the-scheme isovalent substitution of Fe 3+ in Na 3 Fe 2 (PO 4 ) 3 series |
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Taveri, Gianmarco Güneren, Alper Barlog, Martin Hnatko, Miroslav Zhukova, Inga Netriova, Zuzana Šimon, Erik Mičušik, Matej Mikolášek, Miroslav Kaňková, Hana |
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understanding the benefits of al 3+ -doping on nasicons explained through an out-of-the-scheme isovalent substitution of fe 3+ in na 3 fe 2 (po 4 ) 3 series |
| title_auth |
Understanding the benefits of Al 3+ -doping on NaSICONs explained through an out-of-the-scheme isovalent substitution of Fe 3+ in Na 3 Fe 2 (PO 4 ) 3 series |
| abstract |
NaSICON fast-ionic conductors have been largely considered as a viable solution for the development of energy storage units. Chemical doping is a popular technique to improve their electrochemical performance, and the widely accepted criterion is an aliovalent substitution, to increase the cationic density, and/or an isovalent substitution with larger species, to enlarge the bottleneck, as widely speculated for the LATP series. However, this study demonstrates through electrochemical impedance spectroscopy that the ionic conductivity of a Na3Fe2(PO4)3 NaSICON isovalently doped with smaller Al3+ ions to form a Na3AlxFe2-x(PO4)3 NaSICON series can be improved up to 4 times. We resorted to X-ray diffraction and ab initio simulation to show that the NaSICON bottlenecks are enlarged despite the lattice shrinkage and the long-range diffusion path is unlocked for x ≥ 0.5. Moreover, the Al-doping sizeably increases the cohesive energy of the monoclinic lattice, thus stabilizing it. As a result, the cyclic voltammetry and galvanostatic charge-discharge tests of the half-cell battery with Na3AlxFe2-x(PO4)3 as the composite cathode showed better capacity and no decay. We believe that this out-of-the-scheme work will clarify the effects of Al-doping on NaSICON compounds and at the same time contribute to reviving the interest around this highly-sustainable Fe3+-based NaSICON. |
| abstractGer |
NaSICON fast-ionic conductors have been largely considered as a viable solution for the development of energy storage units. Chemical doping is a popular technique to improve their electrochemical performance, and the widely accepted criterion is an aliovalent substitution, to increase the cationic density, and/or an isovalent substitution with larger species, to enlarge the bottleneck, as widely speculated for the LATP series. However, this study demonstrates through electrochemical impedance spectroscopy that the ionic conductivity of a Na3Fe2(PO4)3 NaSICON isovalently doped with smaller Al3+ ions to form a Na3AlxFe2-x(PO4)3 NaSICON series can be improved up to 4 times. We resorted to X-ray diffraction and ab initio simulation to show that the NaSICON bottlenecks are enlarged despite the lattice shrinkage and the long-range diffusion path is unlocked for x ≥ 0.5. Moreover, the Al-doping sizeably increases the cohesive energy of the monoclinic lattice, thus stabilizing it. As a result, the cyclic voltammetry and galvanostatic charge-discharge tests of the half-cell battery with Na3AlxFe2-x(PO4)3 as the composite cathode showed better capacity and no decay. We believe that this out-of-the-scheme work will clarify the effects of Al-doping on NaSICON compounds and at the same time contribute to reviving the interest around this highly-sustainable Fe3+-based NaSICON. |
| abstract_unstemmed |
NaSICON fast-ionic conductors have been largely considered as a viable solution for the development of energy storage units. Chemical doping is a popular technique to improve their electrochemical performance, and the widely accepted criterion is an aliovalent substitution, to increase the cationic density, and/or an isovalent substitution with larger species, to enlarge the bottleneck, as widely speculated for the LATP series. However, this study demonstrates through electrochemical impedance spectroscopy that the ionic conductivity of a Na3Fe2(PO4)3 NaSICON isovalently doped with smaller Al3+ ions to form a Na3AlxFe2-x(PO4)3 NaSICON series can be improved up to 4 times. We resorted to X-ray diffraction and ab initio simulation to show that the NaSICON bottlenecks are enlarged despite the lattice shrinkage and the long-range diffusion path is unlocked for x ≥ 0.5. Moreover, the Al-doping sizeably increases the cohesive energy of the monoclinic lattice, thus stabilizing it. As a result, the cyclic voltammetry and galvanostatic charge-discharge tests of the half-cell battery with Na3AlxFe2-x(PO4)3 as the composite cathode showed better capacity and no decay. We believe that this out-of-the-scheme work will clarify the effects of Al-doping on NaSICON compounds and at the same time contribute to reviving the interest around this highly-sustainable Fe3+-based NaSICON. |
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Understanding the benefits of Al 3+ -doping on NaSICONs explained through an out-of-the-scheme isovalent substitution of Fe 3+ in Na 3 Fe 2 (PO 4 ) 3 series |
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Chemical doping is a popular technique to improve their electrochemical performance, and the widely accepted criterion is an aliovalent substitution, to increase the cationic density, and/or an isovalent substitution with larger species, to enlarge the bottleneck, as widely speculated for the LATP series. However, this study demonstrates through electrochemical impedance spectroscopy that the ionic conductivity of a Na3Fe2(PO4)3 NaSICON isovalently doped with smaller Al3+ ions to form a Na3AlxFe2-x(PO4)3 NaSICON series can be improved up to 4 times. We resorted to X-ray diffraction and ab initio simulation to show that the NaSICON bottlenecks are enlarged despite the lattice shrinkage and the long-range diffusion path is unlocked for x ≥ 0.5. Moreover, the Al-doping sizeably increases the cohesive energy of the monoclinic lattice, thus stabilizing it. As a result, the cyclic voltammetry and galvanostatic charge-discharge tests of the half-cell battery with Na3AlxFe2-x(PO4)3 as the composite cathode showed better capacity and no decay. We believe that this out-of-the-scheme work will clarify the effects of Al-doping on NaSICON compounds and at the same time contribute to reviving the interest around this highly-sustainable Fe3+-based NaSICON.</subfield></datafield><datafield tag="650" ind1=" " ind2="4"><subfield code="a">NaSICON</subfield></datafield><datafield tag="650" ind1=" " ind2="4"><subfield code="a">Aluminum doping</subfield></datafield><datafield tag="650" ind1=" " ind2="4"><subfield code="a">Electrochemical performance</subfield></datafield><datafield tag="650" ind1=" " ind2="4"><subfield code="a">Crystallographic analysis</subfield></datafield><datafield tag="650" ind1=" " ind2="4"><subfield code="a">Ab-initio simulation</subfield></datafield><datafield tag="650" ind1=" " ind2="4"><subfield code="a">Bottleneck</subfield></datafield><datafield tag="700" ind1="1" ind2=" "><subfield code="a">Güneren, Alper</subfield><subfield code="e">verfasserin</subfield><subfield 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