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Title: Narrowing the Gap between Theoretical and Practical Capacities in Li-Ion Layered Oxide Cathode Materials

Abstract

Although layered lithium oxides have become the cathode of choice for state–of–the–art Li–ion batteries, substantial gaps remain between the practical and theoretical energy densities. With the aim of supporting efforts to close this gap, this work reviews the fundamental operating mechanisms and challenges of Li intercalation in layered oxides, contrasts how these challenges play out differently for different materials (with emphasis on Ni–Co–Al (NCA) and Ni–Mn–Co (NMC) alloys), and summarizes the extensive corpus of modifications and extensions to the layered lithium oxides. Particular emphasis is given to the fundamental mechanisms behind the operation and degradation of layered intercalation electrode materials as well as novel modifications and extensions, including Na–ion and cation–disordered materials.

Authors:
ORCiD logo [1];  [2];  [2];  [2];  [2]; ORCiD logo [1];  [2];  [3];  [2];  [1]
  1. Univ. of California Santa Barbara, Santa Barbara, CA (United States)
  2. Univ. of California San Diego, La Jolla, CA (United States)
  3. State Univ. of New York, Binghamton, NY (United States)
Publication Date:
Research Org.:
Energy Frontier Research Centers (EFRC) (United States). Northeastern Center for Chemical Energy Storage (NECCES)
Sponsoring Org.:
USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
OSTI Identifier:
1388252
Alternate Identifier(s):
OSTI ID: 1400638
Grant/Contract Number:  
SC0001294; SC0012583
Resource Type:
Accepted Manuscript
Journal Name:
Advanced Energy Materials
Additional Journal Information:
Journal Volume: 7; Journal Issue: 20; Related Information: NECCES partners with Stony Brook University (lead); Argonne National Laboratory; Binghamton University; Brookhaven National University; University of California, San Diego; University of Cambridge, UK; Lawrence Berkeley National Laboratory; Massachusetts Institute of Technology; University of Michigan; Rutgers University; Journal ID: ISSN 1614-6832
Publisher:
Wiley
Country of Publication:
United States
Language:
English
Subject:
25 ENERGY STORAGE; energy storage (including batteries and capacitors); defects; charge transport; materials and chemistry by design; synthesis (novel materials); layered oxides; Li-ion batteries; phase transformations

Citation Formats

Radin, Maxwell D., Hy, Sunny, Sina, Mahsa, Fang, Chengcheng, Liu, Haodong, Vinckeviciute, Julija, Zhang, Minghao, Whittingham, M. Stanley, Meng, Y. Shirley, and Van der Ven, Anton. Narrowing the Gap between Theoretical and Practical Capacities in Li-Ion Layered Oxide Cathode Materials. United States: N. p., 2017. Web. doi:10.1002/aenm.201602888.
Radin, Maxwell D., Hy, Sunny, Sina, Mahsa, Fang, Chengcheng, Liu, Haodong, Vinckeviciute, Julija, Zhang, Minghao, Whittingham, M. Stanley, Meng, Y. Shirley, & Van der Ven, Anton. Narrowing the Gap between Theoretical and Practical Capacities in Li-Ion Layered Oxide Cathode Materials. United States. doi:10.1002/aenm.201602888.
Radin, Maxwell D., Hy, Sunny, Sina, Mahsa, Fang, Chengcheng, Liu, Haodong, Vinckeviciute, Julija, Zhang, Minghao, Whittingham, M. Stanley, Meng, Y. Shirley, and Van der Ven, Anton. Tue . "Narrowing the Gap between Theoretical and Practical Capacities in Li-Ion Layered Oxide Cathode Materials". United States. doi:10.1002/aenm.201602888. https://www.osti.gov/servlets/purl/1388252.
@article{osti_1388252,
title = {Narrowing the Gap between Theoretical and Practical Capacities in Li-Ion Layered Oxide Cathode Materials},
author = {Radin, Maxwell D. and Hy, Sunny and Sina, Mahsa and Fang, Chengcheng and Liu, Haodong and Vinckeviciute, Julija and Zhang, Minghao and Whittingham, M. Stanley and Meng, Y. Shirley and Van der Ven, Anton},
abstractNote = {Although layered lithium oxides have become the cathode of choice for state–of–the–art Li–ion batteries, substantial gaps remain between the practical and theoretical energy densities. With the aim of supporting efforts to close this gap, this work reviews the fundamental operating mechanisms and challenges of Li intercalation in layered oxides, contrasts how these challenges play out differently for different materials (with emphasis on Ni–Co–Al (NCA) and Ni–Mn–Co (NMC) alloys), and summarizes the extensive corpus of modifications and extensions to the layered lithium oxides. Particular emphasis is given to the fundamental mechanisms behind the operation and degradation of layered intercalation electrode materials as well as novel modifications and extensions, including Na–ion and cation–disordered materials.},
doi = {10.1002/aenm.201602888},
journal = {Advanced Energy Materials},
number = 20,
volume = 7,
place = {United States},
year = {2017},
month = {7}
}

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Cited by: 43 works
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  • Reed, John; Ceder, Gerbrand
  • Chemical Reviews, Vol. 104, Issue 10
  • DOI: 10.1021/cr020733x

Staging Phase Transitions in Li[sub x]CoO[sub 2]
journal, January 2002

  • Chen, Zhaohui; Lu, Zhonghua; Dahn, J. R.
  • Journal of The Electrochemical Society, Vol. 149, Issue 12
  • DOI: 10.1149/1.1519850

Factors affecting Li mobility in spinel LiMn2O4—A first-principles study by GGA and GGA+U methods
journal, August 2010


Issues and Challenges for Bulk-Type All-Solid-State Rechargeable Lithium Batteries using Sulfide Solid Electrolytes
journal, January 2015

  • Jung, Yoon Seok; Oh, Dae Yang; Nam, Young Jin
  • Israel Journal of Chemistry, Vol. 55, Issue 5
  • DOI: 10.1002/ijch.201400112

Lithium batteries: a new tool in solid state chemistry
journal, April 1999


Interface Stability in Solid-State Batteries
journal, December 2015


Quest for Nonaqueous Multivalent Secondary Batteries: Magnesium and Beyond
journal, October 2014

  • Muldoon, John; Bucur, Claudiu B.; Gregory, Thomas
  • Chemical Reviews, Vol. 114, Issue 23
  • DOI: 10.1021/cr500049y

Electrical energy storage for transportation—approaching the limits of, and going beyond, lithium-ion batteries
journal, January 2012

  • Thackeray, Michael M.; Wolverton, Christopher; Isaacs, Eric D.
  • Energy & Environmental Science, Vol. 5, Issue 7
  • DOI: 10.1039/c2ee21892e

Review on electrode–electrolyte solution interactions, related to cathode materials for Li-ion batteries
journal, March 2007


The Role of Surface and Interface Energy on Phase Stability of Nanosized Insertion Compounds
journal, April 2009

  • Wagemaker, Marnix; Mulder, Fokko M.; Van der Ven, Anton
  • Advanced Materials, Vol. 21, Issue 25-26
  • DOI: 10.1002/adma.200803038

Remarkable improvement in cell safety for Li[Ni0.5Co0.2Mn0.3]O2 coated with LiFePO4
journal, March 2010


A Combined Computational/Experimental Study on LiNi 1/3 Co 1/3 Mn 1/3 O 2
journal, September 2003

  • Hwang, B. J.; Tsai, Y. W.; Carlier, D.
  • Chemistry of Materials, Vol. 15, Issue 19
  • DOI: 10.1021/cm030299v

Recharging lithium battery research with first-principles methods
journal, March 2011


Surface reconstruction and chemical evolution of stoichiometric layered cathode materials for lithium-ion batteries
journal, March 2014

  • Lin, Feng; Markus, Isaac M.; Nordlund, Dennis
  • Nature Communications, Vol. 5, Issue 1
  • DOI: 10.1038/ncomms4529

In situ x-ray diffraction and electrochemical studies of Li1−xNiO2
journal, December 1993


Electrochemistry and Structural Chemistry of LiNiO[sub 2] (R3m) for 4 Volt Secondary Lithium Cells
journal, January 1993

  • Ohzuku, Tsutomu
  • Journal of The Electrochemical Society, Vol. 140, Issue 7
  • DOI: 10.1149/1.2220730

Through the eyes of a chemist
journal, December 2015