DOE PAGES title logo U.S. Department of Energy
Office of Scientific and Technical Information

Title: Harnessing the surface structure to enable high-performance cathode materials for lithium-ion batteries

Journal Article · · Chemical Society Reviews
DOI: https://doi.org/10.1039/d0cs00137f · OSTI ID:1774794
ORCiD logo [1];  [1];  [1];  [2]; ORCiD logo [3]; ORCiD logo [1]
  1. Peking Univ., Shenzhen City, Gong Dong (China). Shenzhen Graduate School. School of Advanced Materials
  2. Army Research Lab., Adelphi, MD (United States). Sensor and Electron Devices Electorate
  3. Argonne National Lab. (ANL), Argonne, IL (United States). Electrochemical Technology Program

The ever-increasing demand for high-performance batteries have been driving the fundamental understanding of the crystal/surface structural and electrochemical properties of intercalation cathode materials, among which the olivine-type, spinel and layered lithium transition metal oxide materials have received particular attention in the past decade due to their successful commercialization. While the most current studies focus on the macroscopic and bulk crystal structure of these materials, our previous work suggests that, as a confined region where charge transfer takes place, the interfacial structures of cathode materials largely dictate their electrochemical performances due to the structural symmetry breaking from 3D (bulk) to 2D (surface), which leads to reconstructions under the different chemical/electrochemical conditions. By summarizing works in this subject and offering our perspectives, this tutorial review will reveal for the first time the correlation between surface structure and interface reconstruction at atomic/molecular scales and their direct impact on corresponding electrochemical performances. More importantly, by extending the knowledge obtained from these three well-studied system, we believe that the same principles established could universally apply to other cathode materials that have been the frontiers of new battery chemistries.

Research Organization:
Argonne National Laboratory (ANL), Argonne, IL (United States)
Sponsoring Organization:
National Key Research and Development Program of China; National Natural Science Foundation of China (NSFC); USDOE; USDOE Office of Energy Efficiency and Renewable Energy (EERE), Transportation Office. Vehicle Technologies Office
Grant/Contract Number:
AC02-06CH11357
OSTI ID:
1774794
Journal Information:
Chemical Society Reviews, Journal Name: Chemical Society Reviews Journal Issue: 14 Vol. 49; ISSN 0306-0012
Publisher:
Royal Society of ChemistryCopyright Statement
Country of Publication:
United States
Language:
English

References (49)

Understanding the Degradation Mechanisms of LiNi 0.5 Co 0.2 Mn 0.3 O 2 Cathode Material in Lithium Ion Batteries journal August 2013
Single-Particle Performances and Properties of LiFePO 4 Nanocrystals for Li-Ion Batteries journal November 2016
Surface and Subsurface Reactions of Lithium Transition Metal Oxide Cathode Materials: An Overview of the Fundamental Origins and Remedying Approaches journal September 2018
Ti‐Gradient Doping to Stabilize Layered Surface Structure for High Performance High‐Ni Oxide Cathode of Li‐Ion Battery journal September 2019
Cooling Induced Surface Reconstruction during Synthesis of High‐Ni Layered Oxides journal October 2019
A Soft Chemistry Approach to Coating of LiFePO4 with a Conducting Polymer journal June 2011
Double-Structured LiMn0.85Fe0.15PO4 Coordinated with LiFePO4 for Rechargeable Lithium Batteries journal January 2012
Effect of Interfacial Lithium Insertion on the Stability and Electronic Structure of Graphene/LiFePO4 journal September 2017
Review on electrode–electrolyte solution interactions, related to cathode materials for Li-ion batteries journal March 2007
Nature of LiFePO4 aging process: Roles of impurity phases journal September 2013
Concentration-gradient LiMn0.8Fe0.2PO4 cathode material for high performance lithium ion battery journal February 2016
Soft-contact conductive carbon enabling depolarization of LiFePO4 cathodes to enhance both capacity and rate performances of lithium ion batteries journal November 2016
Phytic acid derived LiFePO 4 beyond theoretical capacity as high-energy density cathode for lithium ion battery journal April 2017
In-situ mass-electrochemical study of surface redox potential and interfacial chemical reactions of Li(Na)FePO 4 nanocrystals for Li(Na)-ion batteries journal July 2017
In-situ self-polymerization restriction to form core-shell LiFePO4/C nanocomposite with ultrafast rate capability for high-power Li-ion batteries journal September 2017
The role of anions on the Helmholtz Plane for the solid-liquid interface in aqueous rechargeable lithium batteries journal August 2020
Ni/Li Disordering in Layered Transition Metal Oxide: Electrochemical Impact, Origin, and Control journal June 2019
Revealing Insights into Li x FePO 4 Nanocrystals with Magnetic Order at Room Temperature Resulting in Trapping of Li Ions journal August 2019
Prelithiation Activates Li(Ni 0.5 Mn 0.3 Co 0.2 )O 2 for High Capacity and Excellent Cycling Stability journal July 2015
Janus Solid–Liquid Interface Enabling Ultrahigh Charging and Discharging Rate for Advanced Lithium-Ion Batteries journal August 2015
Atomic-Scale Observations of (010) LiFePO 4 Surfaces Before and After Chemical Delithiation journal August 2016
Aligned Li + Tunnels in Core–Shell Li(Ni x Mn y Co z )O 2 @LiFePO 4 Enhances Its High Voltage Cycling Stability as Li-ion Battery Cathode journal September 2016
Excess Li-Ion Storage on Reconstructed Surfaces of Nanocrystals To Boost Battery Performance journal September 2017
Understanding the Effect of Atomic-Scale Surface Migration of Bridging Ions in Binding Li 3 PO 4 to the Surface of Spinel Cathode Materials journal December 2018
Revealing the Degradation Mechanism of LiMn x Fe 1– x PO 4 by the Single-Particle Electrochemistry Method journal December 2018
Vanadium-Substituted LiCoPO 4 Core with a Monolithic LiFePO 4 Shell for High-Voltage Lithium-Ion Batteries journal December 2016
Calculations of Li-Ion Diffusion in Olivine Phosphates journal September 2011
Enhanced Charge-Transfer Kinetics by Anion Surface Modification of LiFePO 4 journal August 2012
Lowering Charge Transfer Barrier of LiMn 2 O 4 via Nickel Surface Doping To Enhance Li + Intercalation Kinetics at Subzero Temperatures journal August 2019
Depolarized and Fully Active Cathode Based on Li(Ni 0.5 Co 0.2 Mn 0.3 )O 2 Embedded in Carbon Nanotube Network for Advanced Batteries journal July 2014
Battery materials for ultrafast charging and discharging journal March 2009
Graphene-modified LiFePO4 cathode for lithium ion battery beyond theoretical capacity journal April 2013
Charge transfer kinetics at the solid–solid interface in porous electrodes journal April 2014
Unlocking the energy capabilities of micron-sized LiFePO4 journal August 2015
Nanostructured high-energy cathode materials for advanced lithium batteries journal October 2012
The role of nanotechnology in the development of battery materials for electric vehicles journal December 2016
Formation of size-dependent and conductive phase on lithium iron phosphate during carbon coating journal March 2018
Double-slit photoelectron interference in strong-field ionization of the neon dimer journal January 2019
Tailoring grain boundary structures and chemistry of Ni-rich layered cathodes for enhanced cycle stability of lithium-ion batteries journal June 2018
Building ultraconformal protective layers on both secondary and primary particles of layered lithium transition metal oxide cathodes journal May 2019
Fluid-enhanced surface diffusion controls intraparticle phase transformations journal September 2018
Strategies for improving the cyclability and thermo-stability of LiMn 2 O 4 -based batteries at elevated temperatures journal January 2015
Why LiFePO 4 is a safe battery electrode: Coulomb repulsion induced electron-state reshuffling upon lithiation journal January 2015
High-performance NaFePO 4 formed by aqueous ion-exchange and its mechanism for advanced sodium ion batteries journal January 2016
Achieving high specific capacity of lithium-ion battery cathodes by modification with “N–O˙” radicals and oxygen-containing functional groups journal January 2017
Insights into Li/Ni ordering and surface reconstruction during synthesis of Ni-rich layered oxides journal January 2019
Spherical concentration-gradient LiMn1.87Ni0.13O4 spinel as a high performance cathode for lithium ion batteries journal January 2013
Phospho-olivines as Positive-Electrode Materials for Rechargeable Lithium Batteries journal April 1997
Synthesis of LiFePO 4 Nanocomposite with Surface Conductive Phase by Zr Doping with Li Excess for Fast Discharging journal January 2019