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Unlocking New Redox Activity in Alluaudite Cathodes through Compositional Design

Journal Article · · Chem. Mater.
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Research Organization:
Argonne National Lab. (ANL), Argonne, IL (United States). Advanced Photon Source (APS)
Sponsoring Organization:
DOE - Office Of Science; National Science Foundation (NSF)
OSTI ID:
1878376
Journal Information:
Chem. Mater., Vol. 34, Issue (9)
Country of Publication:
United States
Language:
ENGLISH

References (97)

A cost and resource analysis of sodium-ion batteries journal March 2018
Polyanion-Type Electrode Materials for Sodium-Ion Batteries journal January 2017
The battery business: Lithium availability and the growth of the global electric car industry journal April 2017
Lithium-Ion Battery Supply Chain Considerations: Analysis of Potential Bottlenecks in Critical Metals journal October 2017
Towards K-Ion and Na-Ion Batteries as “Beyond Li-Ion” journal February 2018
Fundamentals and perspectives in developing zinc-ion battery electrolytes: a comprehensive review journal January 2020
Mg rechargeable batteries: an on-going challenge journal January 2013
2021 roadmap for sodium-ion batteries journal July 2021
Direct Recycling R&D at the ReCell Center journal May 2021
Sustainable design of fully recyclable all solid-state batteries journal July 2020
Efficient Direct Recycling of Lithium-Ion Battery Cathodes by Targeted Healing journal December 2020
Unexpected discovery of low-cost maricite NaFePO 4 as a high-performance electrode for Na-ion batteries journal January 2015
Na 2 Mn 3 O 7 : A Suitable Electrode Material for Na-Ion Batteries? journal May 2017
Sol–gel preparation and electrochemical properties of Na3V2(PO4)2F3/C composite cathode material for lithium ion batteries journal June 2009
Single Crystalline Na 0.7 MnO 2 Nanoplates as Cathode Materials for Sodium-Ion Batteries with Enhanced Performance journal July 2013
Review—Manganese-Based P2-Type Transition Metal Oxides as Sodium-Ion Battery Cathode Materials journal January 2015
Reversible Mn2+/Mn4+ double redox in lithium-excess cathode materials journal April 2018
Comparison of electrochemical performances of olivine NaFePO 4 in sodium-ion batteries and olivine LiFePO 4 in lithium-ion batteries journal January 2013
Understanding intercalation compounds for sodium-ion batteries and beyond
  • Kaufman, Jonas L.; Vinckevičiūtė, Julija; Krishna Kolli, Sanjeev
  • Philosophical Transactions of the Royal Society A: Mathematical, Physical and Engineering Sciences, Vol. 377, Issue 2152 https://doi.org/10.1098/rsta.2019.0020
journal July 2019
Polyanionic (Phosphates, Silicates, Sulfates) Frameworks as Electrode Materials for Rechargeable Li (or Na) Batteries journal June 2013
Crystal Structures and Electrode Performance of Alpha-NaFeO2 for Rechargeable Sodium Batteries journal January 2012
An advanced cathode for Na-ion batteries with high rate and excellent structural stability journal January 2013
P2-NaxVO2 system as electrodes for batteries and electron-correlated materials journal November 2012
Electrochemical investigation of the P2–NaxCoO2 phase diagram journal December 2010
Electrochemical intercalation of sodium in NaxCoO2 bronzes journal August 1981
New Cathode Materials for Rechargeable Lithium Batteries: The 3-D Framework Structures Li3Fe2(XO4)3(X=P, As) journal February 1998
Structure and Stability of Sodium Intercalated Phases in Olivine FePO 4 journal July 2010
Carbon coated Na3V2(PO4)3 as novel electrode material for sodium ion batteries journal January 2012
Na 2 FeP 2 O 7 as a Promising Iron-Based Pyrophosphate Cathode for Sodium Rechargeable Batteries: A Combined Experimental and Theoretical Study journal October 2012
Crystal-Chemical Guide for Understanding Redox Energy Variations of M 2+/3+ Couples in Polyanion Cathodes for Lithium-Ion Batteries journal October 2013
Effect of Structure on the Fe[sup 3+]∕Fe[sup 2+] Redox Couple in Iron Phosphates journal January 1997
Li0.75Mn1.50Fe1.75(PO4)3: First alluaudite-type iron phosphate containing only Li+ as alkaline ions journal September 2018
LiFePO4 with an alluaudite crystal structure for lithium ion batteries journal January 2013
NaMnFe 2 (PO 4 ) 3 Alluaudite Phase: Synthesis, Structure, and Electrochemical Properties As Positive Electrode in Lithium and Sodium Batteries journal October 2010
Self-Assembled Alluaudite Na 2 Fe 3− x Mn x (PO 4 ) 3 Micro/Nanocompounds for Sodium-Ion Battery Electrodes: A New Insight into Their Electronic and Geometric Structure journal November 2014
Synthesis, Crystal Structure, and Electrochemical Properties of Alluaudite Na 1.702 Fe 3 (PO 4 ) 3 as a Sodium-Ion Battery Cathode journal June 2017
A 3.8-V earth-abundant sodium battery electrode journal July 2014
Alluaudite Battery Cathodes journal April 2020
Alluaudite LiMnPO 4 : a new Mn-based positive electrode for Li rechargeable batteries journal January 2014
An alluaudite-type sodium-ion battery cathode candidate Na2Mn2V(PO4)3: Crystal growth, preparation, structure and electrochemical properties journal April 2019
Alluaudite NaCoFe 2 (PO 4 ) 3 as a 2.9 V Cathode for Sodium-Ion Batteries Exhibiting Bifunctional Electrocatalytic Activity journal August 2019
Alluaudite Na 2 Co 2 Fe(PO 4 ) 3 as an electroactive material for sodium ion batteries journal January 2015
Structural Study of the Li 0.5 Na 0.5 MnFe 2 (PO 4 ) 3 and Li 0.75 Na 0.25 MnFe 2 (PO 4 ) 3 Alluaudite Phases and Their Electrochemical Properties As Positive Electrodes in Lithium Batteries journal November 2010
CTAB-assisted multiwalled carbon nanotube-loaded NaFe 2 Mn(PO 4 ) 3 materials as high performance cathodes for sodium-ion batteries journal January 2016
α-Na 2 Ni 2 Fe(PO 4 ) 3 : a dual positive/negative electrode material for sodium ion batteries journal January 2015
Effect of divalent transition metal ions on physical, morphological, electrical and electrochemical properties of alluaudite phases Na2M2+2Fe3+(PO4)3 (M = Mn, Co and Ni): Cathode materials for sodium-ions batteries journal April 2022
Unveiling the sodium intercalation properties in Na1.86□0.14Fe3(PO4)3 journal August 2016
Revisiting the alluaudite NaMnFe2(PO4)3 sodium insertion material: Structural, diffusional and electrochemical insights journal September 2018
Na 2 M 2 (SO 4 ) 3 (M = Fe, Mn, Co and Ni): towards high-voltage sodium battery applications journal January 2016
Na 2.32 Co 1.84 (SO 4 ) 3 as a new member of the alluaudite family of high-voltage sodium battery cathodes journal January 2017
Off-Stoichiometry in Alluaudite-Type Sodium Iron Sulfate Na 2+2 x Fe 2− x (SO 4 ) 3 as an Advanced Sodium Battery Cathode Material journal April 2015
An alluaudite Na2+2xFe2−x(SO4)3(x=0.2) derivative phase as insertion host for lithium battery journal February 2015
Transition from ionic to electronic conduction in silver–vanadate–phosphate glasses journal April 1999
High electronic conductivity in nanostructured materials based on lithium-iron-vanadate-phosphate glasses journal April 2015
The alluaudite-type crystal structures of Na 2 (Fe/Co) 2 Co(VO 4 ) 3 and Ag 2 (Fe/Co) 2 Co(VO 4 ) 3 journal June 2016
Synthesis and Characterization of Vanadium-Doped LiMnPO 4 -Compounds: LiMn(PO 4 ) x (VO 4 ) 1– x (0.8 ≤ x ≤ 1.0) journal December 2012
Additional Sodium Insertion into Polyanionic Cathodes for Higher-Energy Na-Ion Batteries journal May 2017
Crystal structure of disilver(I) dizinc(II) iron(III) tris(orthovanadate) with an alluaudite-type structure journal July 2018
Magnetic properties of a new cobalt hydrogen vanadate with a dumortierite-like structure: Co 13.5 (OH) 6 (H 0.5 VO 3.5 ) 2 (VO 4 ) 6 journal May 2019
A novel alluaudite-type vanadate, Na2Zn2Fe(VO4)3: Synthesis, crystal structure, characterization and magnetic properties journal September 2019
Synthesis, Characterization, and Magnetic Properties of A2Co2Fe(VO4)3 (A = Ag or Na) Alluaudite-Type Vanadates journal December 2018
Structural properties of the alluaudite-type materials Ag2–xNaxMn3(VO4)3 (x=0.62 and 1.85) journal September 2019
Sodium Transition Metal Vanadates from Hydrothermal Brines: Synthesis and Characterization of NaMn 4 (VO 4 ) 3 , Na 2 Mn 3 (VO 4 ) 3 , and Na 2 Co 3 (VO 4 ) 2 (OH) 2 journal August 2020
Synthesis, Crystal Structure, and Properties of the Alluaudite-Type Vanadates Ag 2– x Na x Mn 2 Fe(VO 4 ) 3 journal April 2016
Density Functional Theory-Based Bond Pathway Decompositions of Hyperfine Shifts: Equipping Solid-State NMR to Characterize Atomic Environments in Paramagnetic Materials journal April 2013
Spin-Transfer Pathways in Paramagnetic Lithium Transition-Metal Phosphates from Combined Broadband Isotropic Solid-State MAS NMR Spectroscopy and DFT Calculations journal October 2012
Insights into the Nature and Evolution upon Electrochemical Cycling of Planar Defects in the β-NaMnO 2 Na-Ion Battery Cathode: An NMR and First-Principles Density Functional Theory Approach journal November 2016
Direct evidence for high Na + mobility and high voltage structural processes in P2-Na x [Li y Ni z Mn 1−y−z ]O 2 (x, y, z ≤ 1) cathodes from solid-state NMR and DFT calculations journal January 2017
Identifying the Distribution of Al 3+ in LiNi 0.8 Co 0.15 Al 0.05 O 2 journal October 2016
Linking Local Environments and Hyperfine Shifts: A Combined Experimental and Theoretical 31 P and 7 Li Solid-State NMR Study of Paramagnetic Fe(III) Phosphates journal December 2010
Solid-state NMR Studies of Al-doped and Al2O3-coated LiCoO2 journal November 2004
Recent advances in application of 27 Al NMR spectroscopy to materials science journal May 2016
A pre-edge analysis of Mn K-edge XANES spectra to help determine the speciation of manganese in minerals and glasses journal July 2008
Theory of the Role of Covalence in the Perovskite-Type Manganites [ La ,   M ( II ) ] Mn O 3 journal October 1955
An interpretation of the magnetic properties of the perovskite-type mixed crystals La1−xSrxCoO3−λ journal August 1958
Superexchange interaction and symmetry properties of electron orbitals journal July 1959
Phospho-olivines as Positive-Electrode Materials for Rechargeable Lithium Batteries journal April 1997
Mapping of Transition Metal Redox Energies in Phosphates with NASICON Structure by Lithium Intercalation journal January 1997
SoftBV – a software tool for screening the materials genome of inorganic fast ion conductors journal January 2019
Selective sodium-ion diffusion channels in Na2-xFe3(PO4)3 positive electrode for Na-ion batteries journal January 2020
Sodium Intercalation Mechanism of 3.8 V Class Alluaudite Sodium Iron Sulfate journal July 2016
TOPAS and TOPAS-Academic : an optimization program integrating computer algebra and crystallographic objects written in C++ journal February 2018
VESTA : a three-dimensional visualization system for electronic and structural analysis journal May 2008
Modelling one- and two-dimensional solid-state NMR spectra: Modelling 1D and 2D solid-state NMR spectra journal December 2001
ATHENA , ARTEMIS , HEPHAESTUS : data analysis for X-ray absorption spectroscopy using IFEFFIT journal June 2005
Quantum-mechanical condensed matter simulations with CRYSTAL
  • Dovesi, Roberto; Erba, Alessandro; Orlando, Roberto
  • Wiley Interdisciplinary Reviews: Computational Molecular Science, Vol. 8, Issue 4 https://doi.org/10.1002/wcms.1360
journal March 2018
Python Materials Genomics (pymatgen): A robust, open-source python library for materials analysis journal February 2013
Accurate spin-dependent electron liquid correlation energies for local spin density calculations: a critical analysis journal August 1980
Development of the Colle-Salvetti correlation-energy formula into a functional of the electron density journal January 1988
A new mixing of Hartree–Fock and local density‐functional theories journal January 1993
Ab Initio Calculation of Vibrational Absorption and Circular Dichroism Spectra Using Density Functional Force Fields journal November 1994
On the prediction of band gaps from hybrid functional theory journal July 2001
Effect of Fock exchange on the electronic structure and magnetic coupling in NiO journal March 2002
A solid-state hybrid density functional theory study of Prussian blue analogues and related chlorides at pressure journal July 2008
Magnetic coupling constants from a hybrid density functional with 35% Hartree-Fock exchange journal September 2004
Fully optimized contracted Gaussian basis sets for atoms Li to Kr journal August 1992
Special points for Brillouin-zone integrations journal June 1976

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