skip to main content
OSTI.GOV title logo U.S. Department of Energy
Office of Scientific and Technical Information

Title: Voltage-Relaxation GITT and Reverse Monte Carlo to Determine Lithium Diffusion and Distribution in TiO 2 and Highly-Ordered Nanoporous Hard Carbons

Abstract

Not provided.

Authors:
ORCiD logo; ; ; ORCiD logo
Publication Date:
Research Org.:
Univ. of Missouri, Columbia, MO (United States)
Sponsoring Org.:
USDOE Office of Energy Efficiency and Renewable Energy (EERE)
OSTI Identifier:
1541802
DOE Contract Number:  
EE0007656
Resource Type:
Journal Article
Journal Name:
Journal of the Electrochemical Society
Additional Journal Information:
Journal Volume: 165; Journal Issue: 11; Journal ID: ISSN 0013-4651
Publisher:
The Electrochemical Society
Country of Publication:
United States
Language:
English
Subject:
Electrochemistry; Materials Science

Citation Formats

Jayawardana, Waruni, Carr, Christopher L., Zhao, Dongxue, and Majzoub, Eric H. Voltage-Relaxation GITT and Reverse Monte Carlo to Determine Lithium Diffusion and Distribution in TiO 2 and Highly-Ordered Nanoporous Hard Carbons. United States: N. p., 2018. Web. doi:10.1149/2.1121811jes.
Jayawardana, Waruni, Carr, Christopher L., Zhao, Dongxue, & Majzoub, Eric H. Voltage-Relaxation GITT and Reverse Monte Carlo to Determine Lithium Diffusion and Distribution in TiO 2 and Highly-Ordered Nanoporous Hard Carbons. United States. doi:10.1149/2.1121811jes.
Jayawardana, Waruni, Carr, Christopher L., Zhao, Dongxue, and Majzoub, Eric H. Mon . "Voltage-Relaxation GITT and Reverse Monte Carlo to Determine Lithium Diffusion and Distribution in TiO 2 and Highly-Ordered Nanoporous Hard Carbons". United States. doi:10.1149/2.1121811jes.
@article{osti_1541802,
title = {Voltage-Relaxation GITT and Reverse Monte Carlo to Determine Lithium Diffusion and Distribution in TiO 2 and Highly-Ordered Nanoporous Hard Carbons},
author = {Jayawardana, Waruni and Carr, Christopher L. and Zhao, Dongxue and Majzoub, Eric H.},
abstractNote = {Not provided.},
doi = {10.1149/2.1121811jes},
journal = {Journal of the Electrochemical Society},
issn = {0013-4651},
number = 11,
volume = 165,
place = {United States},
year = {2018},
month = {1}
}

Works referenced in this record:

Review on recent progress of nanostructured anode materials for Li-ion batteries
journal, July 2014


A high-performance hard carbon for Li-ion batteries and supercapacitors application
journal, February 2013


Carbon-Based Materials for Lithium-Ion Batteries, Electrochemical Capacitors, and Their Hybrid Devices
journal, July 2015


Influence of the Pyrolysis Conditions on the Nature of Lithium Inserted in Hard Carbons
journal, June 2001

  • Gautier, S.; Leroux, F.; Frackowiak, E.
  • The Journal of Physical Chemistry A, Vol. 105, Issue 24
  • DOI: 10.1021/jp000892p

Insertion Electrode Materials for Rechargeable Lithium Batteries
journal, July 1998


Reduction of the Irreversible Capacity in Hard-Carbon Anode Materials Prepared from Sucrose for Li-Ion Batteries
journal, January 1998

  • Buiel, Edward
  • Journal of The Electrochemical Society, Vol. 145, Issue 6
  • DOI: 10.1149/1.1838585

Li-insertion in hard carbon anode materials for Li-ion batteries
journal, September 1999


On the irreversible capacities of disordered carbons in lithium-ion rechargeable batteries
journal, January 2000


Fullerene-related structure of commercial glassy carbons
journal, October 2004


Recent advances in lithium ion battery materials
journal, May 2000


On the Reduction of Lithium Insertion Capacity in Hard-Carbon Anode Materials with Increasing Heat-Treatment Temperature
journal, January 1998

  • Buiel, Edward
  • Journal of The Electrochemical Society, Vol. 145, Issue 7
  • DOI: 10.1149/1.1838629

Anodic performance and insertion mechanism of hard carbons prepared from synthetic isotropic pitches
journal, March 2001


Mechanisms for Lithium Insertion in Carbonaceous Materials
journal, October 1995


The Mechanisms of Lithium and Sodium Insertion in Carbon Materials
journal, January 2001

  • Stevens, D. A.; Dahn, J. R.
  • Journal of The Electrochemical Society, Vol. 148, Issue 8
  • DOI: 10.1149/1.1379565

Electrochemical reduction of nano-SiO2 in hard carbon as anode material for lithium ion batteries
journal, December 2008


SnO2-carbon composites for lithium-ion battery anodes
journal, June 2001


Electrochemical properties of an ordered mesoporous carbon prepared by direct tri-constituent co-assembly
journal, November 2007


A comparative study of ordered mesoporous carbons with different pore structures as anode materials for lithium-ion batteries
journal, January 2015

  • Saikia, Diganta; Wang, Tzu-Hua; Chou, Chieh-Ju
  • RSC Advances, Vol. 5, Issue 53
  • DOI: 10.1039/C5RA05168A

Carbon Materials for Chemical Capacitive Energy Storage
journal, September 2011


Controlling the Decomposition Pathway of LiBH 4 via Confinement in Highly Ordered Nanoporous Carbon
journal, July 2010

  • Liu, Xiangfeng; Peaslee, David; Jost, C. Z.
  • The Journal of Physical Chemistry C, Vol. 114, Issue 33
  • DOI: 10.1021/jp1055045

Surface-Functionalized Nanoporous Carbons for Kinetically Stabilized Complex Hydrides through Lewis Acid–Lewis Base Chemistry
journal, May 2016


Anomalous H 2 Desorption Rate of NaAlH 4 Confined in Nitrogen-Doped Nanoporous Carbon Frameworks
journal, April 2018


Tailoring the hydrogen storage properties of Li4BN3H10 by confinement into highly ordered nanoporous carbon
journal, January 2013

  • Liu, Xiangfeng; Peaslee, David; Majzoub, E. H.
  • Journal of Materials Chemistry A, Vol. 1, Issue 12
  • DOI: 10.1039/c3ta00174a

Enhanced Hydrogen Storage Kinetics of LiBH4 in Nanoporous Carbon Scaffolds
journal, March 2008

  • Gross, Adam F.; Vajo, John J.; Van Atta, Sky L.
  • The Journal of Physical Chemistry C, Vol. 112, Issue 14, p. 5651-5657
  • DOI: 10.1021/jp711066t

The kinetic enhancement of hydrogen cycling in NaAlH 4 by melt infusion into nanoporous carbon aerogel
journal, April 2009


Carbon-based materials as supercapacitor electrodes
journal, January 2009

  • Zhang, Li Li; Zhao, X. S.
  • Chemical Society Reviews, Vol. 38, Issue 9
  • DOI: 10.1039/b813846j

Electrochemical Na Insertion and Solid Electrolyte Interphase for Hard-Carbon Electrodes and Application to Na-Ion Batteries
journal, August 2011

  • Komaba, Shinichi; Murata, Wataru; Ishikawa, Toru
  • Advanced Functional Materials, Vol. 21, Issue 20
  • DOI: 10.1002/adfm.201100854

Recent Advancements in Li-Ion Conductors for All-Solid-State Li-Ion Batteries
journal, November 2017


A review of lithium and non-lithium based solid state batteries
journal, May 2015


Development of bulk-type all-solid-state lithium-sulfur battery using LiBH 4 electrolyte
journal, August 2014

  • Unemoto, Atsushi; Yasaku, Syun; Nogami, Genki
  • Applied Physics Letters, Vol. 105, Issue 8
  • DOI: 10.1063/1.4893666

Fabrication and Performance of All-Solid-State Li–Air Battery with SWCNTs/LAGP Cathode
journal, July 2015

  • Liu, Yijie; Li, Bojie; Kitaura, Hirokazu
  • ACS Applied Materials & Interfaces, Vol. 7, Issue 31
  • DOI: 10.1021/acsami.5b04409

High-Performance All-Solid-State Lithium–Sulfur Battery Enabled by a Mixed-Conductive Li 2 S Nanocomposite
journal, June 2016


A Family of Highly Ordered Mesoporous Polymer Resin and Carbon Structures from Organic−Organic Self-Assembly
journal, September 2006

  • Meng, Yan; Gu, Dong; Zhang, Fuqiang
  • Chemistry of Materials, Vol. 18, Issue 18
  • DOI: 10.1021/cm060921u

Triconstituent Co-assembly to Ordered Mesostructured Polymer−Silica and Carbon−Silica Nanocomposites and Large-Pore Mesoporous Carbons with High Surface Areas
journal, September 2006

  • Liu, Ruili; Shi, Yifeng; Wan, Ying
  • Journal of the American Chemical Society, Vol. 128, Issue 35
  • DOI: 10.1021/ja0633518

Synthesis of New, Nanoporous Carbon with Hexagonally Ordered Mesostructure
journal, November 2000

  • Jun, Shinae; Joo, Sang Hoon; Ryoo, Ryong
  • Journal of the American Chemical Society, Vol. 122, Issue 43
  • DOI: 10.1021/ja002261e

Mesoporous Carbon Materials: Synthesis and Modification
journal, May 2008

  • Liang, Chengdu; Li, Zuojiang; Dai, Sheng
  • Angewandte Chemie International Edition, Vol. 47, Issue 20, p. 3696-3717
  • DOI: 10.1002/anie.200702046

Determination of the Kinetic Parameters of Mixed-Conducting Electrodes and Application to the System Li[sub 3]Sb
journal, January 1977

  • Weppner, W.
  • Journal of The Electrochemical Society, Vol. 124, Issue 10
  • DOI: 10.1149/1.2133112

Determination of the Lithium Ion Diffusion Coefficient in Graphite
journal, January 1999

  • Yu, Ping
  • Journal of The Electrochemical Society, Vol. 146, Issue 1
  • DOI: 10.1149/1.1391556

Large Impact of Particle Size on Insertion Reactions. A Case for Anatase Li x TiO 2
journal, April 2007

  • Wagemaker, Marnix; Borghols, Wouter J. H.; Mulder, Fokko M.
  • Journal of the American Chemical Society, Vol. 129, Issue 14
  • DOI: 10.1021/ja067733p

Density Functional Characterization of the Band Edges, the Band Gap States, and the Preferred Doping Sites of Halogen-Doped TiO 2
journal, October 2008

  • Yang, Kesong; Dai, Ying; Huang, Baibiao
  • Chemistry of Materials, Vol. 20, Issue 20
  • DOI: 10.1021/cm801741m

GGA + U description of lithium intercalation into anatase TiO 2
journal, October 2010


In Situ Structural Changes upon Electrochemical Lithium Insertion in Nanosized Anatase TiO 2
journal, December 2009

  • Lafont, U.; Carta, D.; Mountjoy, G.
  • The Journal of Physical Chemistry C, Vol. 114, Issue 2
  • DOI: 10.1021/jp908786t

Impact of Particle Size on the Non-Equilibrium Phase Transition of Lithium-Inserted Anatase TiO 2
journal, February 2014

  • Shen, Kun; Chen, Hao; Klaver, Frits
  • Chemistry of Materials, Vol. 26, Issue 4
  • DOI: 10.1021/cm4037346

Role of Lithium Ordering in the Li x TiO 2 Anatase → Titanate Phase Transition
journal, June 2011

  • Morgan, Benjamin J.; Watson, Graeme W.
  • The Journal of Physical Chemistry Letters, Vol. 2, Issue 14
  • DOI: 10.1021/jz200718e

The electronic structure and ionic diffusion of nanoscale LiTiO2 anatase
journal, January 2009

  • Borghols, W. J. H.; Lützenkirchen-Hecht, D.; Haake, U.
  • Physical Chemistry Chemical Physics, Vol. 11, Issue 27
  • DOI: 10.1039/b823142g

Stable Numerical Solution of the Adsorption Integral Equation Using Splines
journal, August 1994


NIH Image to ImageJ: 25 years of image analysis
journal, June 2012

  • Schneider, Caroline A.; Rasband, Wayne S.; Eliceiri, Kevin W.
  • Nature Methods, Vol. 9, Issue 7
  • DOI: 10.1038/nmeth.2089

Fityk : a general-purpose peak fitting program
journal, September 2010


Glassy carbon as electrode material in electro- analytical chemistry
journal, September 1980


Density functional theory methods for characterization of porous materials
journal, November 2013

  • Landers, John; Gor, Gennady Yu.; Neimark, Alexander V.
  • Colloids and Surfaces A: Physicochemical and Engineering Aspects, Vol. 437
  • DOI: 10.1016/j.colsurfa.2013.01.007

Characterization of Electronic and Ionic Transport in Li 1- x Ni 0 . 8 Co 0.15 Al 0.05 O 2 (NCA)
journal, January 2015

  • Amin, Ruhul; Ravnsbæk, Dorthe Bomholdt; Chiang, Yet-Ming
  • Journal of The Electrochemical Society, Vol. 162, Issue 7
  • DOI: 10.1149/2.0171507jes

The Kohlrausch function: properties and applications
journal, December 2003


On the relationship among three theories of relaxation in disordered systems
journal, February 1986

  • Klafter, J.; Shlesinger, M. F.
  • Proceedings of the National Academy of Sciences, Vol. 83, Issue 4
  • DOI: 10.1073/pnas.83.4.848

Relaxation Anomalies in Linear Polymer Melts
journal, April 2002


Normalized Weibull distribution for modeling rehydration of food particulates
journal, October 2003

  • Marabi, A.; Livings, S.; Jacobson, M.
  • European Food Research and Technology, Vol. 217, Issue 4
  • DOI: 10.1007/s00217-003-0719-y

Parameterization of a Physico-Chemical Model of a Lithium-Ion Battery: I. Determination of Parameters
journal, January 2015

  • Ecker, Madeleine; Tran, Thi Kim Dung; Dechent, Philipp
  • Journal of The Electrochemical Society, Vol. 162, Issue 9
  • DOI: 10.1149/2.0551509jes

Galvanostatic Intermittent Titration Technique for Phase-Transformation Electrodes
journal, January 2010

  • Zhu, Yujie; Wang, Chunsheng
  • The Journal of Physical Chemistry C, Vol. 114, Issue 6
  • DOI: 10.1021/jp9113333

A review of conduction phenomena in Li-ion batteries
journal, December 2010


Study of nano-porous hard carbons as anode materials for lithium ion batteries
journal, August 2012


Diffusion coefficient of lithium in artificial graphite, mesocarbon microbeads, and disordered carbon
journal, March 2007


Lithium Diffusion in Graphitic Carbon
journal, March 2010

  • Persson, Kristin; Sethuraman, Vijay A.; Hardwick, Laurence J.
  • The Journal of Physical Chemistry Letters, Vol. 1, Issue 8
  • DOI: 10.1021/jz100188d

Observation of Lithium Dendrites at Ambient Temperature and Below
journal, December 2014

  • Love, C. T.; Baturina, O. A.; Swider-Lyons, K. E.
  • ECS Electrochemistry Letters, Vol. 4, Issue 2
  • DOI: 10.1149/2.0041502eel

Internal Morphologies of Cycled Li-Metal Electrodes Investigated by Nano-Scale Resolution X-ray Computed Tomography
journal, May 2017

  • Frisco, Sarah; Liu, Danny X.; Kumar, Arjun
  • ACS Applied Materials & Interfaces, Vol. 9, Issue 22
  • DOI: 10.1021/acsami.7b03003

A review of lithium deposition in lithium-ion and lithium metal secondary batteries
journal, May 2014


Understanding undesirable anode lithium plating issues in lithium-ion batteries
journal, January 2016

  • Liu, Qianqian; Du, Chunyu; Shen, Bin
  • RSC Advances, Vol. 6, Issue 91
  • DOI: 10.1039/C6RA19482F

Onset of dendritic growth in lithium/polymer cells
journal, July 2001


Suppression of Dendrite Formation via Pulse Charging in Rechargeable Lithium Metal Batteries
journal, December 2012

  • Mayers, Matthew Z.; Kaminski, Jakub W.; Miller, Thomas F.
  • The Journal of Physical Chemistry C, Vol. 116, Issue 50
  • DOI: 10.1021/jp309321w

Visualization of Lithium Plating and Stripping via in Operando Transmission X-ray Microscopy
journal, March 2017

  • Cheng, Ju-Hsiang; Assegie, Addisu Alemayehu; Huang, Chen-Jui
  • The Journal of Physical Chemistry C, Vol. 121, Issue 14
  • DOI: 10.1021/acs.jpcc.7b01414

Electrochemical properties and Li deposition morphologies of surface modified graphite after grinding
journal, April 2009


Mechanisms for Lithium Nucleation and Dendrite Growth in Selected Carbon Allotropes
journal, July 2017


Defect-induced plating of lithium metal within porous graphene networks
journal, April 2014

  • Mukherjee, Rahul; Thomas, Abhay V.; Datta, Dibakar
  • Nature Communications, Vol. 5, Issue 1
  • DOI: 10.1038/ncomms4710

In situ detection of lithium metal plating on graphite in experimental cells
journal, April 2015