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

Title: Understanding improved electrochemical properties of NiO-doped NiF2–C composite conversion materials by X-ray absorption spectroscopy and pair distribution function analysis

Authors:
; ; ; ; ; ;
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:
1384806
DOE Contract Number:  
SC0001294
Resource Type:
Journal Article
Journal Name:
Physical Chemistry Chemical Physics. PCCP (Print)
Additional Journal Information:
Journal Volume: 16; Journal Issue: 7; 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 1463-9076
Publisher:
Royal Society of Chemistry
Country of Publication:
United States
Language:
English
Subject:
energy storage (including batteries and capacitors), defects, charge transport, materials and chemistry by design, synthesis (novel materials)

Citation Formats

Lee, Dae Hoe, Carroll, Kyler J., Chapman, Karena W., Borkiewicz, Olaf J., Calvin, Scott, Fullerton, Eric E., and Meng, Ying Shirley. Understanding improved electrochemical properties of NiO-doped NiF2–C composite conversion materials by X-ray absorption spectroscopy and pair distribution function analysis. United States: N. p., 2014. Web. doi:10.1039/C3CP54431A.
Lee, Dae Hoe, Carroll, Kyler J., Chapman, Karena W., Borkiewicz, Olaf J., Calvin, Scott, Fullerton, Eric E., & Meng, Ying Shirley. Understanding improved electrochemical properties of NiO-doped NiF2–C composite conversion materials by X-ray absorption spectroscopy and pair distribution function analysis. United States. doi:10.1039/C3CP54431A.
Lee, Dae Hoe, Carroll, Kyler J., Chapman, Karena W., Borkiewicz, Olaf J., Calvin, Scott, Fullerton, Eric E., and Meng, Ying Shirley. Wed . "Understanding improved electrochemical properties of NiO-doped NiF2–C composite conversion materials by X-ray absorption spectroscopy and pair distribution function analysis". United States. doi:10.1039/C3CP54431A.
@article{osti_1384806,
title = {Understanding improved electrochemical properties of NiO-doped NiF2–C composite conversion materials by X-ray absorption spectroscopy and pair distribution function analysis},
author = {Lee, Dae Hoe and Carroll, Kyler J. and Chapman, Karena W. and Borkiewicz, Olaf J. and Calvin, Scott and Fullerton, Eric E. and Meng, Ying Shirley},
abstractNote = {},
doi = {10.1039/C3CP54431A},
journal = {Physical Chemistry Chemical Physics. PCCP (Print)},
issn = {1463-9076},
number = 7,
volume = 16,
place = {United States},
year = {2014},
month = {1}
}

Works referenced in this record:

Nano-sized transition-metal oxides as negative-electrode materials for lithium-ion batteries
journal, September 2000

  • Poizot, P.; Laruelle, S.; Grugeon, S.
  • Nature, Vol. 407, Issue 6803, p. 496-499
  • DOI: 10.1038/35035045

ATHENA , ARTEMIS , HEPHAESTUS : data analysis for X-ray absorption spectroscopy using IFEFFIT
journal, June 2005


Metal hydrides for lithium-ion batteries
journal, October 2008

  • Oumellal, Y.; Rougier, A.; Nazri, G. A.
  • Nature Materials, Vol. 7, Issue 11, p. 916-921
  • DOI: 10.1038/nmat2288

Carbon Metal Fluoride Nanocomposites: High-Capacity Reversible Metal Fluoride Conversion Materials as Rechargeable Positive Electrodes for Li Batteries
journal, January 2003

  • Badway, F.; Cosandey, F.; Pereira, N.
  • Journal of The Electrochemical Society, Vol. 150, Issue 10, p. A1318-A1327
  • DOI: 10.1149/1.1602454

Rapid-acquisition pair distribution function (RA-PDF) analysis
journal, November 2003

  • Chupas, Peter J.; Qiu, Xiangyun; Hanson, Jonathan C.
  • Journal of Applied Crystallography, Vol. 36, Issue 6, p. 1342-1347
  • DOI: 10.1107/S0021889803017564

Bismuth Fluoride Nanocomposite as a Positive Electrode Material for Rechargeable Lithium Batteries
journal, January 2005

  • Bervas, M.; Badway, F.; Klein, L. C.
  • Electrochemical and Solid-State Letters, Vol. 8, Issue 4, p. A179-A183
  • DOI: 10.1149/1.1861040

A Transmission Electron Microscopy Study of the Reactivity Mechanism of Tailor-Made CuO Particles toward Lithium
journal, January 2001

  • Débart, A.; Dupont, L.; Poizot, P.
  • Journal of The Electrochemical Society, Vol. 148, Issue 11
  • DOI: 10.1149/1.1409971

Beyond Intercalation-Based Li-Ion Batteries: The State of the Art and Challenges of Electrode Materials Reacting Through Conversion Reactions
journal, August 2010

  • Cabana, Jordi; Monconduit, Laure; Larcher, Dominique
  • Advanced Materials, Vol. 22, Issue 35
  • DOI: 10.1002/adma.201000717

Investigation of the Lithiation and Delithiation Conversion Mechanisms of Bismuth Fluoride Nanocomposites
journal, January 2006

  • Bervas, M.; Mansour, A. N.; Yoon, W.-S.
  • Journal of The Electrochemical Society, Vol. 153, Issue 4, p. A799-A808
  • DOI: 10.1149/1.2167951

Recent advances in magnetic structure determination by neutron powder diffraction
journal, October 1993


Tracking lithium transport and electrochemical reactions in nanoparticles
journal, January 2012

  • Wang, Feng; Yu, Hui-Chia; Chen, Min-Hua
  • Nature Communications, Vol. 3, Issue 1
  • DOI: 10.1038/ncomms2185

Conversion mechanism of nickel fluoride and NiO-doped nickel fluoride in Li ion batteries
journal, January 2012


Direct observation of the structure of gold nanoparticles by total scattering powder neutron diffraction
journal, August 2004


Thermodynamics and Kinetics of the Li/FeF 3 Reaction by Electrochemical Analysis
journal, February 2012

  • Liu, Ping; Vajo, John J.; Wang, John S.
  • The Journal of Physical Chemistry C, Vol. 116, Issue 10
  • DOI: 10.1021/jp211927g

Li-Storage via Heterogeneous Reaction in Selected Binary Metal Fluorides and Oxides
journal, January 2004

  • Li, Hong; Balaya, Palani; Maier, Joachim
  • Journal of The Electrochemical Society, Vol. 151, Issue 11, p. A1878-A1885
  • DOI: 10.1149/1.1801451

Carbon-Metal Fluoride Nanocomposites: Structure and Electrochemistry of FeF3 : C
journal, January 2003

  • Badway, F.; Pereira, N.; Cosandey, F.
  • Journal of The Electrochemical Society, Vol. 150, Issue 9, p. A1209-A1218
  • DOI: 10.1149/1.1596162

Building better batteries
journal, February 2008

  • Armand, M.; Tarascon, J.-M.
  • Nature, Vol. 451, Issue 7179, p. 652-657
  • DOI: 10.1038/451652a

Structural and Mechanistic Revelations on an Iron Conversion Reaction from Pair Distribution Function Analysis
journal, April 2012

  • Shyam, Badri; Chapman, Karena W.; Balasubramanian, Mahalingam
  • Angewandte Chemie International Edition, Vol. 51, Issue 20
  • DOI: 10.1002/anie.201200244

Determination of the electronic structure of transition-metal compounds: 2p x-ray photoemission spectroscopy of the nickel dihalides
journal, June 1986


Experimental evidences of lattice distortion in Nanocrystalline Materials
journal, January 1999


Fully Reversible Homogeneous and Heterogeneous Li Storage in RuO2 with High Capacity
journal, August 2003


Conversion Reaction Mechanisms in Lithium Ion Batteries: Study of the Binary Metal Fluoride Electrodes
journal, November 2011

  • Wang, Feng; Robert, Rosa; Chernova, Natasha A.
  • Journal of the American Chemical Society, Vol. 133, Issue 46
  • DOI: 10.1021/ja206268a

Fluoride based electrode materials for advanced energy storage devices
journal, April 2007


Magnitude and Origin of the Band Gap in NiO
journal, December 1984


PDFgetX2: a GUI-driven program to obtain the pair distribution function from X-ray powder diffraction data
journal, July 2004

  • Qiu, Xiangyun; Thompson, Jeroen W.; Billinge, Simon J. L.
  • Journal of Applied Crystallography, Vol. 37, Issue 4, p. 678-678
  • DOI: 10.1107/S0021889804011744

Estimating Crystallite Size in Polydispersed Samples using EXAFS
journal, January 2005


Iron Oxyfluorides as High Capacity Cathode Materials for Lithium Batteries
journal, January 2009

  • Pereira, N.; Badway, F.; Wartelsky, M.
  • Journal of The Electrochemical Society, Vol. 156, Issue 6, p. A407-A416
  • DOI: 10.1149/1.3106132

Investigation of the Conversion Reaction Mechanisms for Binary Copper(II) Compounds by Solid-State NMR Spectroscopy and X-ray Diffraction
journal, July 2009

  • Yamakawa, Naoko; Jiang, Meng; Grey, Clare P.
  • Chemistry of Materials, Vol. 21, Issue 14
  • DOI: 10.1021/cm900581b

A new iron oxyfluoride cathode active material for Li-ion battery, Fe2OF4
journal, August 2009


Conversion Reaction of FeF 2 Thin Films upon Exposure to Atomic Lithium
journal, May 2012

  • Rangan, Sylvie; Thorpe, Ryan; Bartynski, Robert Allen
  • The Journal of Physical Chemistry C, Vol. 116, Issue 19
  • DOI: 10.1021/jp300669d

IFEFFIT  : interactive XAFS analysis and FEFF fitting
journal, March 2001


Near-edge x-ray-absorption fine structure of Pb: A comparison of theory and experiment
journal, June 1993


Rutile-type compounds. IV. SiO2, GeO2 and a comparison with other rutile-type structures
journal, November 1971

  • Baur, W. H.; Khan, A. A.
  • Acta Crystallographica Section B Structural Crystallography and Crystal Chemistry, Vol. 27, Issue 11
  • DOI: 10.1107/S0567740871005466

Comprehensive Insights into the Structural and Chemical Changes in Mixed-Anion FeOF Electrodes by Using Operando PDF and NMR Spectroscopy
journal, March 2013

  • Wiaderek, Kamila M.; Borkiewicz, Olaf J.; Castillo-Martínez, Elizabeth
  • Journal of the American Chemical Society, Vol. 135, Issue 10
  • DOI: 10.1021/ja400229v

Applications of an amorphous silicon-based area detector for high-resolution, high-sensitivity and fast time-resolved pair distribution function measurements
journal, May 2007

  • Chupas, Peter J.; Chapman, Karena W.; Lee, Peter L.
  • Journal of Applied Crystallography, Vol. 40, Issue 3
  • DOI: 10.1107/S0021889807007856

Two-dimensional detector software: From real detector to idealised image or two-theta scan
journal, January 1996

  • Hammersley, A. P.; Svensson, S. O.; Hanfland, M.
  • High Pressure Research, Vol. 14, Issue 4-6, p. 235-248
  • DOI: 10.1080/08957959608201408

Structure and Electrochemistry of Copper Fluoride Nanocomposites Utilizing Mixed Conducting Matrices
journal, August 2007

  • Badway, F.; Mansour, A. N.; Pereira, N.
  • Chemistry of Materials, Vol. 19, Issue 17, p. 4129-4141
  • DOI: 10.1021/cm070421g