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Lithium and sodium battery cathode materials: computational insights into voltage, diffusion and nanostructural properties

https://doi.org/10.1039/c3cs60199d
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Nanomaterials for Rechargeable Lithium Batteries
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High‐Voltage Pyrophosphate Cathode: Insights into Local Structure and Lithium‐Diffusion Pathways
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A thermodynamic study of sodium-intercalated TaS2 and TiS2
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Fast Na+-ion transport in skeleton structures
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Electrochemical intercalation of sodium in NaxCoO2 bronzes
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Lithium mobility in the layered oxide Li1−xCoO2
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Sodium and sodium-ion energy storage batteries
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Electrical conductivity of doped LiCoPO4
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Cathode materials: A personal perspective
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Recent developments in cathode materials for lithium ion batteries
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A review of conduction phenomena in Li-ion batteries
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Lithium diffusion in Li4Ti5O12 at high temperatures
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First-principles studies of the effects of impurities on the ionic and electronic conduction in LiFePO4
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Review and analysis of nanostructured olivine-based lithium recheargeable batteries: Status and trends
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The hydrothermal synthesis and characterization of olivines and related compounds for electrochemical applications
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Energy storage beyond the horizon: Rechargeable lithium batteries
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Structural, electronic and Li diffusion properties of LiFeSO4F
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Simulated defect and interface engineering for high power Li electrode materials
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Structural changes on cycling Li2FeSiO4 polymorphs from DFT calculations
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Ion transport in sodium ion conducting solid electrolytes
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A new crystalline LiPON electrolyte: Synthesis, properties, and electronic structure
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Hartree–Fock geometry optimisation of periodic systems with the Crystal code
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Structural disorder along the lithium diffusion pathway in cubically stabilized lithium manganese spinel II. Molecular dynamics calculation
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Lithium diffusion mechanisms in layered intercalation compounds
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Electroactivity of natural and synthetic triphylite
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Solid state calculations using WIEN2k
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Recent Advances in First Principles Computational Research of Cathode Materials for Lithium-Ion Batteries
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First-Principles Investigation of Phase Stability in the O2-LiCoO2 System
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Atomic-Scale Investigation of Defects, Dopants, and Lithium Transport in the LiFePO4 Olivine-Type Battery Material
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Lithium Coordination Sites in LixTiO2(B): A Structural and Computational Study
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Iron and Manganese Pyrophosphates as Cathodes for Lithium-Ion Batteries
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Alkali-ion Conduction Paths in LiFeSO4F and NaFeSO4F Tavorite-Type Cathode Materials
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Tailoring Native Defects in LiFePO 4 : Insights from First-Principles Calculations
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Evaluation of Tavorite-Structured Cathode Materials for Lithium-Ion Batteries Using High-Throughput Computing
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Phosphates as Lithium-Ion Battery Cathodes: An Evaluation Based on High-Throughput ab Initio Calculations
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Neutron and X-ray Diffraction Study of Pyrophosphate-Based Li2–xMP2O7 (M = Fe, Co) for Lithium Rechargeable Battery Electrodes
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Calculations of Li-Ion Diffusion in Olivine Phosphates
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Crystal Structure, Energetics, And Electrochemistry of Li2FeSiO4 Polymorphs from First Principles Calculations
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Thermodynamics of Lithium in TiO2(B) from First Principles
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Ab Initio Study of the Sodium Intercalation and Intermediate Phases in Na0.44MnO2 for Sodium-Ion Battery
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Structure, Defect Chemistry, and Lithium Transport Pathway of Lithium Transition Metal Pyrophosphates (Li2MP2O7, M: Mn, Fe, and Co): Atomistic Simulation Study
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Nanostructuring of β-MnO 2 : The Important Role of Surface to Bulk Ion Migration
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Electrochemistry of Hollandite α-MnO 2 : Li-Ion and Na-Ion Insertion and Li 2 O Incorporation
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Lithium Battery Materials Li M PO 4 ( M = Mn, Fe, Co, and Ni): Insights into Defect Association, Transport Mechanisms, and Doping Behavior
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Lithium Insertion and Transport in the TiO2−B Anode Material: A Computational Study
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Tailoring the Morphology of LiCoO 2 : A First Principles Study
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Challenges for Rechargeable Li Batteries
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Li2MnSiO4 Lithium Battery Material: Atomic-Scale Study of Defects, Lithium Mobility, and Trivalent Dopants
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Positive Electrode Materials for Li-Ion and Li-Batteries
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Anti-Site Defects and Ion Migration in the LiFe0.5Mn0.5PO4Mixed-Metal Cathode Material
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Lithium Batteries and Cathode Materials
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Polyanionic (Phosphates, Silicates, Sulfates) Frameworks as Electrode Materials for Rechargeable Li (or Na) Batteries
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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
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New Lithium Iron Pyrophosphate as 3.5 V Class Cathode Material for Lithium Ion Battery
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Structure and Lithium Transport Pathways in Li2FeSiO4 Cathodes for Lithium Batteries
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Structural Modulation in the High Capacity Battery Cathode Material LiFeBO3
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New Iron-Based Mixed-Polyanion Cathodes for Lithium and Sodium Rechargeable Batteries: Combined First Principles Calculations and Experimental Study
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The Li-Ion Rechargeable Battery: A Perspective
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Anomalous Manganese Activation of a Pyrophosphate Cathode in Sodium Ion Batteries: A Combined Experimental and Theoretical Study
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Predicting the Electrochemical Properties of MnO2 Nanomaterials Used in Rechargeable Li Batteries: Simulating Nanostructure at the Atomistic Level
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Electronic Structure, Chemical Bonding, and Vibronic Coupling in MnIV/MnIIIMixed Valent LixMn2O4Spinels and Their Effect on the Dynamics of Intercalated Li: A Cluster Study Using DFT
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Computer Simulation of the Phase Stabilities of Lithiated TiO2 Polymorphs
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Hybrid Density Functional Calculations and Molecular Dynamics Study of Lithium Fluorosulphate, A Cathode Material for Lithium-Ion Batteries
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First-Principles Calculations on the LiMSO4F/MSO4F (M = Fe, Co, and Ni) Systems
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Theoretical Fingerprints of Transition Metal L2,3 XANES and ELNES for Lithium Transition Metal Oxides by ab Initio Multiplet Calculations
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Li Ion Diffusion Mechanisms in LiFePO4: An ab Initio Molecular Dynamics Study
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Atomistic Simulation Study of Mixed-Metal Oxide (LiNi1/3Co1/3Mn1/3O2) Cathode Material for Lithium Ion Battery
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First-Principles Modeling of the Initial Stages of Organic Solvent Decomposition on LixMn2O4(100) Surfaces
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Formation of Perpendicular Graphene Nanosheets on LiFePO4: A First-Principles Characterization
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Calculations of Oxygen Stability in Lithium-Rich Layered Cathodes
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Surface Properties of LiCoO2 Investigated by XPS Analyses and Theoretical Calculations
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Atomistic Simulation Studies of Lithium and Proton Insertion in Spinel Lithium Manganates
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Particle Size Dependence of the Ionic Diffusivity
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Nanosize Storage Properties in Spinel Li4Ti5O12 Explained by Anisotropic Surface Lithium Insertion
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Building better batteries
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Nanoionics: ion transport and electrochemical storage in confined systems
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Experimental visualization of lithium diffusion in LixFePO4
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A 3.6 V lithium-based fluorosulphate insertion positive electrode for lithium-ion batteries
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Electrochemical investigation of the P2–NaxCoO2 phase diagram
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The lithium intercalation process in the low-voltage lithium battery anode Li1+xV1−xO2
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A lithium superionic conductor
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Li–O2 and Li–S batteries with high energy storage
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P2-type Nax[Fe1/2Mn1/2]O2 made from earth-abundant elements for rechargeable Na batteries
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Electronically conductive phospho-olivines as lithium storage electrodes
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Calculated cell discharge curve for lithium batteries with a V2O5 cathode
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New British Standards
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DL_POLY_3: new dimensions in molecular dynamics simulations via massive parallelism
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High performance computing in materials chemistry
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Synthesis of nanocrystals and morphology control of hydrothermally prepared LiFePO4
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Surface structures and crystal morphologies of LiFePO4: relevance to electrochemical behaviour
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Nanoscale networking of LiFePO4 nanorods synthesized by a microwave-solvothermal route with carbon nanotubes for lithium ion batteries
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Recent advances in rechargeable battery materials: a chemist’s perspective
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Changes in the crystal and electronic structure of LiCoO2 and LiNiO2 upon Li intercalation and de-intercalation
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First principles computational materials design for energy storage materials in lithium ion batteries
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A first principles investigation of lithium intercalation in TiO2-B
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Density functional theory for transition metals and transition metal chemistry
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Ab initio molecular dynamics simulations of the initial stages of solid–electrolyte interphase formation on lithium ion battery graphitic anodes
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6Li MAS NMR spectroscopy and first-principles calculations as a combined tool for the investigation of Li2MnSiO4 polymorphs
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Heterogeneous nanostructured electrode materials for electrochemical energy storage
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Amorphization and recrystallization study of lithium insertion into manganese dioxide
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Silicate cathodes for lithium batteries: alternatives to phosphates?
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Atomistic investigation of Li+ diffusion pathways in the olivine LiFePO4 cathode material
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inferred← citeshttps://doi.org/10.1002/celc.201800642openalex-snapshot
Cellulose‐Templated, Dual‐Carbonized Na3V2(PO4)3 for Energy Storage with High Rate Capability
inferred← citeshttps://doi.org/10.1002/celc.201800838openalex-snapshot
Activity – Stability Volcano Plots for the Investigation of Nano‐Sized Electrode Materials in Lithium‐Ion Batteries
inferred← citeshttps://doi.org/10.1002/celc.201900766openalex-snapshot
A First‐Principles Study of Boron‐Doped BC2N Sheet as Potential Anode Material for Li/Na‐Ion Batteries
inferred← citeshttps://doi.org/10.1002/celc.202000099openalex-snapshot
Intercalation Lithium Cobalt Oxide for the Facile Fabrication of a Sensitive Dopamine Sensor
inferred← citeshttps://doi.org/10.1002/celc.202001087openalex-snapshot
A Scalable Approach to Na2FeP2O7@Carbon/Expanded Graphite as a Low‐Cost and High‐Performance Cathode for Sodium‐Ion Batteries
inferred← citeshttps://doi.org/10.1002/celc.202101626openalex-snapshot
Co‐Doping Strategies to Improve the Electrochemical Properties of LixMn2O4 Cathodes for Li‐Ion Batteries
inferred← citeshttps://doi.org/10.1002/celc.202200219openalex-snapshot
4‐Fluorophenylsulfonylacetonitrile as an Electrolyte Additive for Improving the High‐Voltage Performance of LiNi 0.83 Co 0.11 Mn 0.06 O 2 Cathode Batteries
inferred← citeshttps://doi.org/10.1002/celc.202200722openalex-snapshot
Initial Stages of Sodium Deposition onto Au(111) from [MPPip][TFSI]: An In‐Situ STM Study for Sodium‐Ion Battery Electrolytes
inferred← citeshttps://doi.org/10.1002/celc.202201041openalex-snapshot
Ni 3 Se 4 Nanostructure as a Battery‐type Positive Electrode for Hybrid Capacitors
inferred← citeshttps://doi.org/10.1002/celc.202300333openalex-snapshot
Quantum Chemical Analysis of the Correlation between Electrode Potential and Redox Center of Li‐Insertion Materials: Olivine, Layered and Spinel Structures, and Aqua‐Complexes
inferred← citeshttps://doi.org/10.1002/celc.202400484openalex-snapshot
Core‐Shell Amorphous FePO4 as Cathode Material for Lithium‐Ion and Sodium‐Ion Batteries
inferred← citeshttps://doi.org/10.1002/chem.201502050openalex-snapshot
High Performance Full Sodium‐Ion Cell Based on a Nanostructured Transition Metal Oxide as Negative Electrode
inferred← citeshttps://doi.org/10.1002/chem.202500707openalex-snapshot
α‐Iminonitrile‐Linked Covalent Organic Framework Synthesized by Ehrlich–Sachs Reaction as a Promising Cathode for Sodium‐Ion Batteries
inferred← citeshttps://doi.org/10.1002/chem.70934openalex-snapshot
Packing Dense Redox‐Active Centers in Covalent Organic Framework Electrodes for High‐Performance Sodium‐ and Potassium‐Ion Batteries: A Review
inferred← citeshttps://doi.org/10.1002/chin.201414276openalex-snapshot
ChemInform Abstract: Lithium and Sodium Battery Cathode Materials: Computational Insights into Voltage, Diffusion and Nanostructural Properties
inferred← citeshttps://doi.org/10.1002/cnl2.177openalex-snapshot
A chronicle of titanium niobium oxide materials for high‐performance lithium‐ion batteries: From laboratory to industry
inferred← citeshttps://doi.org/10.1002/cnl2.62openalex-snapshot
Typical cathode materials for lithium‐ion and sodium‐ion batteries: From structural design to performance optimization
inferred← citeshttps://doi.org/10.1002/cnma.202000327openalex-snapshot
Structural, defect, transport and dopant properties of AgNbO3
inferred← citeshttps://doi.org/10.1002/cplu.201402267openalex-snapshot
Microemulsion‐Assisted Synthesis of Nanosized LiMnO Spinel Cathodes for High‐Rate Lithium‐Ion Batteries
inferred← citeshttps://doi.org/10.1002/cplu.202300044openalex-snapshot
Effects of Various Valence Ions on an Aqueous Rechargeable Zn//Polyaniline‐coated ZnMn2O4 Battery
inferred← citeshttps://doi.org/10.1002/cssc.201801439openalex-snapshot
In Situ Growth of Zeolitic Imidazolate Framework‐67‐derived Nanoporous Carbon@K0.5Mn2O4 for High‐Performance 2.4 V Aqueous Asymmetric Supercapacitors
inferred← citeshttps://doi.org/10.1002/cssc.201802450openalex-snapshot
Redox‐Mediator‐Enhanced Electrochemical Capacitors: Recent Advances and Future Perspectives
inferred← citeshttps://doi.org/10.1002/cssc.201900298openalex-snapshot
Recent Advancements Towards Closing the Gap between Electrocatalysis and Battery Science Communities: The Computational Lithium Electrode and Activity–Stability Volcano Plots
inferred← citeshttps://doi.org/10.1002/cssc.201900798openalex-snapshot
Capacitive Sodium‐Ion Storage Based on Double‐Layered Mesoporous Graphene with High Capacity and Charging/Discharging Rate
inferred← citeshttps://doi.org/10.1002/cssc.202201184openalex-snapshot
Recent Progress on Phosphate Cathode Materials for Aqueous Zinc‐Ion Batteries
inferred← citeshttps://doi.org/10.1002/cssc.202401886openalex-snapshot
Conceptualizing Surface‐Like Diffusion for Ultrafast Ionic Conduction in Solid‐State Materials
inferred← citeshttps://doi.org/10.1002/eem2.12692openalex-snapshot
Phase Engineering of MXene Derivatives Via Molecular Design for High‐Rate Sodium‐Ion Batteries
inferred← citeshttps://doi.org/10.1002/eem2.70474openalex-snapshot
Finite Element Analysis for Li Batteries at the Mesoscale
inferred← citeshttps://doi.org/10.1002/ente.201402160openalex-snapshot
Up‐Scaled Microspherical Aggregates of LiFe0.4V0.4PO4/C Nanocomposites as Cathode Materials for High‐Rate Li‐Ion Batteries
inferred← citeshttps://doi.org/10.1002/ente.202300464openalex-snapshot
Conducting Polyacrylamide–Polyaniline Polymers as Water‐Soluble Binder in LiFePO4 Cathode for Lithium‐Ion Batteries
inferred← citeshttps://doi.org/10.1002/er.5769openalex-snapshot
A facile control in free‐carbon domain with divinylbenzene for the high‐rate‐performing Sb/ SiOC composite anode material in sodium‐ion batteries
inferred← citeshttps://doi.org/10.1002/er.6383openalex-snapshot
Optimization of prismatic type layered electrode materials for high performance sodium battery
inferred← citeshttps://doi.org/10.1002/er.8103openalex-snapshot
Modern practices in electrophoretic deposition to manufacture energy storage electrodes
inferred← citeshttps://doi.org/10.1002/est2.70367openalex-snapshot
Synergistic Alloying of Na and P in LiMnSi Half ‐Heusler Alloy for Improved Metal‐Ion Battery Performance
inferred← citeshttps://doi.org/10.1002/ijch.201500064openalex-snapshot
Study of the Most Relevant Aspects Related to Hard Carbons as Anode Materials for Na‐ion Batteries, Compared with Li‐ion Systems
inferred← citeshttps://doi.org/10.1002/ijch.201900116openalex-snapshot
Review of Computational Studies of NCM Cathode Materials for Li‐ion Batteries
inferred← citeshttps://doi.org/10.1002/nano.202000030openalex-snapshot
Manganese‐based layered oxide cathodes for sodium ion batteries
inferred← citeshttps://doi.org/10.1002/ppsc.201500129openalex-snapshot
Sodium‐Deficient O3‐Na0.9[Ni0.4MnxTi0.6−x]O2 Layered‐Oxide Cathode Materials for Sodium‐Ion Batteries
inferred← citeshttps://doi.org/10.1002/pssb.201700041openalex-snapshot
A first-principles study of bulk and surface Sn-doped LiFePO4 : The role of intermediate valence component in the multivalent doping
inferred← citeshttps://doi.org/10.1002/pssb.201700669openalex-snapshot
Lithium Hexastannate: A Potential Material for Energy Storage
inferred← citeshttps://doi.org/10.1002/pssb.201800568openalex-snapshot
Implications of Oxygen–Sulfur Exchange on Structural, Electronic Properties, and Stability of Alkali‐Metal Hexatitanates
inferred← citeshttps://doi.org/10.1002/pssb.202000106openalex-snapshot
Observation of Liquid Phase Synthesis of Sulfide Solid Electrolytes Using Time‐Resolved Pair Distribution Function Analysis
inferred← citeshttps://doi.org/10.1002/pssr.201409167openalex-snapshot
Systematic calculations of On (n = 1 to 6) polytypes of LiCoO2
inferred← citeshttps://doi.org/10.1002/qua.24948openalex-snapshot
A perspective on the electronic structure calculations for properties of battery electrode materials
inferred← citeshttps://doi.org/10.1002/qua.27044openalex-snapshot
DFT + U calculations of structural, magnetic, and electrochemical properties and Na+ diffusion barrier in the O3 ‐phase of NaTm0 . 5Ni0 . 5O2 (Tm = Ti, Mn)
inferred← citeshttps://doi.org/10.1002/slct.201600293openalex-snapshot
Reduction of Manganese Dioxide by Dissolved Lithium in Liquid Ammonia for Li–Mn‐O Spinels
inferred← citeshttps://doi.org/10.1002/slct.201702273openalex-snapshot
A Stable Cross‐Linked Binder Network for SnO 2 Anode with Enhanced Sodium‐Ion Storage Performance
inferred← citeshttps://doi.org/10.1002/slct.201902685openalex-snapshot
Mg 2+ and Ti 4+ Co–Doped Spinel LiMn 2 O 4 as Lithium‐Ion Battery Cathode
inferred← citeshttps://doi.org/10.1002/slct.202102304openalex-snapshot
Progress of the Elements Doped NaFeO 2 Cathode Materials for High Performance Sodium‐ion Batteries
inferred← citeshttps://doi.org/10.1002/slct.202400746openalex-snapshot
Albumen‐Based Foam Protein Porous Carbon for Supercapacitor Applications
inferred← citeshttps://doi.org/10.1002/smll.201500144openalex-snapshot
A High‐Rate and Ultralong‐Life Sodium‐Ion Battery Based on NaTi2(PO4)3 Nanocubes with Synergistic Coating of Carbon and Rutile TiO2
inferred← citeshttps://doi.org/10.1002/smll.201604181openalex-snapshot
Emerging Prototype Sodium‐Ion Full Cells with Nanostructured Electrode Materials
inferred← citeshttps://doi.org/10.1002/smll.201701744openalex-snapshot
Mesoporous NiS2 Nanospheres Anode with Pseudocapacitance for High‐Rate and Long‐Life Sodium‐Ion Battery
inferred← citeshttps://doi.org/10.1002/smll.201703576openalex-snapshot
Electrolytes, SEI Formation, and Binders: A Review of Nonelectrode Factors for Sodium‐Ion Battery Anodes
inferred← citeshttps://doi.org/10.1002/smll.201805381openalex-snapshot
Recent Progress of Layered Transition Metal Oxide Cathodes for Sodium‐Ion Batteries
inferred← citeshttps://doi.org/10.1002/smll.201805479openalex-snapshot
High‐Safety Nonaqueous Electrolytes and Interphases for Sodium‐Ion Batteries
inferred← citeshttps://doi.org/10.1002/smll.201900628openalex-snapshot
Carbon‐Based Alloy‐Type Composite Anode Materials toward Sodium‐Ion Batteries
inferred← citeshttps://doi.org/10.1002/smll.201903418openalex-snapshot
Cobalt Chalcogenides/Cobalt Phosphides/Cobaltates with Hierarchical Nanostructures for Anode Materials of Lithium‐Ion Batteries: Improving the Lithiation Environment
inferred← citeshttps://doi.org/10.1002/smll.201906607openalex-snapshot
Metal–Semiconductor Phase Twinned Hierarchical MoS2 Nanowires with Expanded Interlayers for Sodium‐Ion Batteries with Ultralong Cycle Life
inferred← citeshttps://doi.org/10.1002/smll.202102641openalex-snapshot
SiOx Anode: From Fundamental Mechanism toward Industrial Application
inferred← citeshttps://doi.org/10.1002/smll.202203383openalex-snapshot
Iron Sulfide Na 2 FeS 2 as Positive Electrode Material with High Capacity and Reversibility Derived from Anion–Cation Redox in All‐Solid‐State Sodium Batteries
inferred← citeshttps://doi.org/10.1002/smll.202404227openalex-snapshot
Aqueous Multivalent Metal‐ion Batteries: Toward 3D‐printed Architectures
inferred← citeshttps://doi.org/10.1002/smll.202407740openalex-snapshot
Electrochemo‐Mechanical Degradation and Failure of Active Particles in High Energy Density Batteries: A Review
inferred← citeshttps://doi.org/10.1002/smll.202504350openalex-snapshot
Selenized Binary Transition Metals‐MXene Composite for High‐Performance Asymmetric Hybrid Capacitors
inferred← citeshttps://doi.org/10.1002/smll.202506866openalex-snapshot
Yolk‐Shell Sodium Iron Sulfate@Carbon for Advanced Sodium Storage with Enhanced Capacity and Stability
inferred← citeshttps://doi.org/10.1002/smtd.201700098openalex-snapshot
Advanced Cathode Materials for Sodium‐Ion Batteries: What Determines Our Choices?
inferred← citeshttps://doi.org/10.1002/smtd.201700293openalex-snapshot
Probing Battery Electrochemistry with In Operando Synchrotron X‐Ray Imaging Techniques
inferred← citeshttps://doi.org/10.1002/smtd.201800367openalex-snapshot
Recent Progress in Micro‐Supercapacitor Design, Integration, and Functionalization
inferred← citeshttps://doi.org/10.1002/smtd.202201387openalex-snapshot
Adjusting Crystal Orientation to Promote Sodium‐Ion Transport in V5S8@Graphene Anode Materials for High‐Performance Sodium‐Ion Batteries
inferred← citeshttps://doi.org/10.1002/smtd.202201724openalex-snapshot
Electrochemistry of Titanium Carbide MXenes in Supercapacitor
inferred← citeshttps://doi.org/10.1002/smtd.202300168openalex-snapshot
Correlating Solid Electrolyte Interphase Composition with Dendrite‐Free and Long Life‐Span Lithium Metal Batteries via Advanced Characterizations and Simulations
inferred← citeshttps://doi.org/10.1002/tcr.201700037openalex-snapshot
Colloidal Supercapattery: Redox Ions in Electrode and Electrolyte
inferred← citeshttps://doi.org/10.1007/978-1-4471-5677-2_6openalex-snapshot
Fuel Cells and Batteries In Silico Experimentation Through Integrative Multiscale Modeling
inferred← citeshttps://doi.org/10.1007/978-3-030-04474-9_3openalex-snapshot
Nanostructured Materials for Li-Ion Battery Applications
inferred← citeshttps://doi.org/10.1007/978-3-030-16800-1_2openalex-snapshot
Cathode Materials, Samples, Pristine, Layered, Doping, Discharge Capacity
inferred← citeshttps://doi.org/10.1007/978-3-031-23401-9_8openalex-snapshot
Electrode Materials for High Energy Density Li-Ion
inferred← citeshttps://doi.org/10.1007/978-3-031-47303-6_13openalex-snapshot
Ab Initio Modeling of Layered Oxide High-Energy Cathodes for Na-Ion Batteries
inferred← citeshttps://doi.org/10.1007/978-3-031-47303-6_15openalex-snapshot
Oxygen Redox in Battery Cathodes: A Brief Overview
inferred← citeshttps://doi.org/10.1007/978-3-031-47303-6_17openalex-snapshot
Design of Improved Cathode Materials by Intermixing Transition Metals in Sodium-Iron Sulphate and Sodium Manganate for Sodium-Ion Batteries
inferred← citeshttps://doi.org/10.1007/978-3-031-47303-6_18openalex-snapshot
Sodium Intercalation into Graphite and Graphene Complexes Towards Advanced Sodium-Ion Battery Anode Materials
inferred← citeshttps://doi.org/10.1007/978-3-319-19108-9_8openalex-snapshot
Fluoro-polyanionic Compounds
inferred← citeshttps://doi.org/10.1007/978-3-319-19454-7_108-1openalex-snapshot
Lithium Intercalation Materials for Battery Prepared by Sol–Gel Method
inferred← citeshttps://doi.org/10.1007/978-3-319-26082-2_14openalex-snapshot
Computational Modelling as a Value Add in Energy Storage Materials
inferred← citeshttps://doi.org/10.1007/978-3-319-32101-1_108openalex-snapshot
Lithium Intercalation Materials for Battery Prepared by Sol-Gel Method
inferred← citeshttps://doi.org/10.1007/978-3-319-42391-3_2openalex-snapshot
Theories and Models of Ion Diffusion
inferred← citeshttps://doi.org/10.1007/978-3-319-68280-8_7openalex-snapshot
Ab Initio Molecular Dynamics Studies of Fast Ion Conductors
inferred← citeshttps://doi.org/10.1007/978-981-13-7643-6_62openalex-snapshot
Structural and Electrical Conductivity Studies of Ce and Zn Substituted LiMn2O4 Cathode Material for Lithium-Ion Batteries
inferred← citeshttps://doi.org/10.1007/978-981-99-5946-4_23openalex-snapshot
Electronic and Electrochemical Properties of Novel Cathode Material NaFeSO4OH by First-Principle Calculations
inferred← citeshttps://doi.org/10.1007/s00214-016-1910-0openalex-snapshot
Sodium adsorption and intercalation in bilayer graphene from density functional theory calculations
inferred← citeshttps://doi.org/10.1007/s00214-017-2064-4openalex-snapshot
Enhancing sampling in atomistic simulations of solid-state materials for batteries: a focus on olivine $$\hbox {NaFePO}_4$$ NaFePO 4
inferred← citeshttps://doi.org/10.1007/s00216-016-9373-7openalex-snapshot
Emerging scanning probe approaches to the measurement of ionic reactivity at energy storage materials
inferred← citeshttps://doi.org/10.1007/s00706-025-03320-wopenalex-snapshot
The first-principles study of calculations and design of LiCoO2 cathode materials
inferred← citeshttps://doi.org/10.1007/s00894-019-4109-1openalex-snapshot
Exploring the effect of phosphorus doping on the utility of g-C3N4 as an electrode material in Na-ion batteries using DFT method
inferred← citeshttps://doi.org/10.1007/s10008-017-3592-5openalex-snapshot
Mechanochemical treatment of maricite-type NaFePO4 for achieving high electrochemical performance
inferred← citeshttps://doi.org/10.1007/s10008-018-4017-9openalex-snapshot
A short perspective of modeling electrode materials in lithium-ion batteries by the ab initio atomistic thermodynamics approach
inferred← citeshttps://doi.org/10.1007/s10008-018-4055-3openalex-snapshot
Enhanced electrochemical performance of electrospun V2O5 fibres doped with redox-inactive metals
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