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Title: Order–disorder transition in nano-rutile TiO 2 anodes: a high capacity low-volume change Li-ion battery material

Abstract

Li-Intercalation in nano-rutile TiO 2 -anodes induces loss of long-range order with the formation of ∼5 nm layered Li x TiO 2 domains with ∼1 nm columbite-like grain boundaries.

Authors:
 [1];  [2];  [3]; ORCiD logo [2]; ORCiD logo [3]; ORCiD logo [1]
  1. Department of Physics, Chemistry and Pharmacy, University of Southern Denmark, 5230 Odense M, Denmark
  2. Center for Materials Crystallography, Department of Chemistry and iNANO, Aarhus University, 8000 Aarhus C, Denmark
  3. Department of Materials Science and Engineering, Massachusetts Institute of Technology, Cambridge, USA
Publication Date:
Sponsoring Org.:
USDOE
OSTI Identifier:
1527046
Grant/Contract Number:  
SC0002626
Resource Type:
Publisher's Accepted Manuscript
Journal Name:
Nanoscale
Additional Journal Information:
Journal Name: Nanoscale Journal Volume: 11 Journal Issue: 25; Journal ID: ISSN 2040-3364
Publisher:
Royal Society of Chemistry (RSC)
Country of Publication:
United Kingdom
Language:
English

Citation Formats

Christensen, Christian Kolle, Mamakhel, Mohammad Aref Hasen, Balakrishna, Ananya Renuka, Iversen, Bo Brummerstedt, Chiang, Yet-Ming, and Ravnsbæk, Dorthe Bomholdt. Order–disorder transition in nano-rutile TiO 2 anodes: a high capacity low-volume change Li-ion battery material. United Kingdom: N. p., 2019. Web. doi:10.1039/C9NR01228A.
Christensen, Christian Kolle, Mamakhel, Mohammad Aref Hasen, Balakrishna, Ananya Renuka, Iversen, Bo Brummerstedt, Chiang, Yet-Ming, & Ravnsbæk, Dorthe Bomholdt. Order–disorder transition in nano-rutile TiO 2 anodes: a high capacity low-volume change Li-ion battery material. United Kingdom. https://doi.org/10.1039/C9NR01228A
Christensen, Christian Kolle, Mamakhel, Mohammad Aref Hasen, Balakrishna, Ananya Renuka, Iversen, Bo Brummerstedt, Chiang, Yet-Ming, and Ravnsbæk, Dorthe Bomholdt. Thu . "Order–disorder transition in nano-rutile TiO 2 anodes: a high capacity low-volume change Li-ion battery material". United Kingdom. https://doi.org/10.1039/C9NR01228A.
@article{osti_1527046,
title = {Order–disorder transition in nano-rutile TiO 2 anodes: a high capacity low-volume change Li-ion battery material},
author = {Christensen, Christian Kolle and Mamakhel, Mohammad Aref Hasen and Balakrishna, Ananya Renuka and Iversen, Bo Brummerstedt and Chiang, Yet-Ming and Ravnsbæk, Dorthe Bomholdt},
abstractNote = {Li-Intercalation in nano-rutile TiO 2 -anodes induces loss of long-range order with the formation of ∼5 nm layered Li x TiO 2 domains with ∼1 nm columbite-like grain boundaries.},
doi = {10.1039/C9NR01228A},
journal = {Nanoscale},
number = 25,
volume = 11,
place = {United Kingdom},
year = {Thu Jun 27 00:00:00 EDT 2019},
month = {Thu Jun 27 00:00:00 EDT 2019}
}

Journal Article:
Free Publicly Available Full Text
Publisher's Version of Record
https://doi.org/10.1039/C9NR01228A

Citation Metrics:
Cited by: 36 works
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Works referenced in this record:

Advanced titania nanostructures and composites for lithium ion battery
journal, September 2011


The mechanics of large-volume-change transformations in high-capacity battery materials
journal, December 2016


Room temperature synthesis and Li insertion into nanocrystalline rutile TiO2
journal, August 2006

  • Reddy, M. Anji; Kishore, M. Satya; Pralong, V.
  • Electrochemistry Communications, Vol. 8, Issue 8, p. 1299-1303
  • DOI: 10.1016/j.elecom.2006.05.021

Low cost photovoltaic modules based on dye sensitized nanocrystalline titanium dioxide and carbon powder
journal, October 1996


High surface area crystalline titanium dioxide: potential and limits in electrochemical energy storage and catalysis
journal, January 2012

  • Fröschl, T.; Hörmann, U.; Kubiak, P.
  • Chemical Society Reviews, Vol. 41, Issue 15
  • DOI: 10.1039/c2cs35013k

Direct Formation of Crystalline Phase Pure Rutile TiO 2 Nanostructures by a Facile Hydrothermal Method
journal, October 2013

  • Mamakhel, Aref; Tyrsted, Christoffer; Bøjesen, Espen Drath
  • Crystal Growth & Design, Vol. 13, Issue 11
  • DOI: 10.1021/cg400858p

Nanostructures and lithium electrochemical reactivity of lithium titanites and titanium oxides: A review
journal, July 2009


The structures of lithium-inserted metal oxides: LiReO3 and Li2ReO3
journal, May 1982


Titanium-Based Anode Materials for Safe Lithium-Ion Batteries
journal, July 2012

  • Chen, Zonghai; Belharouak, Ilias; Sun, Y. -K.
  • Advanced Functional Materials, Vol. 23, Issue 8
  • DOI: 10.1002/adfm.201200698

PDFgetX3 : a rapid and highly automatable program for processing powder diffraction data into total scattering pair distribution functions
journal, March 2013


Synthesis and Li-Ion Insertion Properties of Highly Crystalline Mesoporous Rutile TiO 2
journal, May 2008

  • Wang, Donghai; Choi, Daiwon; Yang, Zhenguo
  • Chemistry of Materials, Vol. 20, Issue 10
  • DOI: 10.1021/cm8002589

A Path Independent Integral and the Approximate Analysis of Strain Concentration by Notches and Cracks
journal, June 1968


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

A Survey of first-row ternary oxides LiMO2 (M = Sc-Cu)
journal, January 1987


Dynamic charge-discharge phase transitions in Li3V2(PO4)3 cathodes
journal, August 2018

  • Sørensen, Daniel Risskov; Mathiesen, Jette Katja; Ravnsbæk, Dorthe Bomholdt
  • Journal of Power Sources, Vol. 396
  • DOI: 10.1016/j.jpowsour.2018.06.023

A review and recent developments in photocatalytic water-splitting using TiO2 for hydrogen production
journal, April 2007

  • Ni, Meng; Leung, Michael K. H.; Leung, Dennis Y. C.
  • Renewable and Sustainable Energy Reviews, Vol. 11, Issue 3
  • DOI: 10.1016/j.rser.2005.01.009

Theoretical study of lithium intercalation in rutile and anatase
journal, January 1996

  • Stashans, Arvids; Lunell, Sten; Bergström, Robert
  • Physical Review B, Vol. 53, Issue 1
  • DOI: 10.1103/PhysRevB.53.159

Electrochemical evaluation of rutile TiO2 nanoparticles as negative electrode for Li-ion batteries
journal, December 2009


Engineering the Transformation Strain in LiMn y Fe 1– y PO 4 Olivines for Ultrahigh Rate Battery Cathodes
journal, March 2016


Effect of Diffusion on Lithium Intercalation in Titanium Dioxide
journal, February 2001

  • Koudriachova, Marina V.; Harrison, Nicholas M.; de Leeuw, Simon W.
  • Physical Review Letters, Vol. 86, Issue 7
  • DOI: 10.1103/PhysRevLett.86.1275

Lithium Insertion into Mesoscopic and Single-Crystal TiO[sub 2] (Rutile) Electrodes
journal, January 1999

  • Kavan, Ladislav
  • Journal of The Electrochemical Society, Vol. 146, Issue 4
  • DOI: 10.1149/1.1391773

Crystal Structure of Titanium and Chromium
journal, July 1925


High Lithium Electroactivity of Nanometer-Sized Rutile TiO2
journal, June 2006

  • Hu, Y.-S.; Kienle, L.; Guo, Y.-G.
  • Advanced Materials, Vol. 18, Issue 11, p. 1421-1426
  • DOI: 10.1002/adma.200502723

Three-phase junction for modulating electron–hole migration in anatase–rutile photocatalysts
journal, January 2015

  • Zhao, Wei-Na; Zhu, Sheng-Cai; Li, Ye-Fei
  • Chemical Science, Vol. 6, Issue 6
  • DOI: 10.1039/C5SC00621J

Columbite-Type TiO 2 as a Negative Electrode Material for Lithium-Ion Batteries
journal, January 2017

  • Mukai, Kazuhiko; Yamada, Ikuya
  • Journal of The Electrochemical Society, Vol. 164, Issue 14
  • DOI: 10.1149/2.0481714jes

Structural evolution during the reaction of Li with nano-sized rutile type TiO2 at room temperature
journal, February 2007


Impact of Nanosizing on Lithiated Rutile TiO 2
journal, May 2008

  • Borghols, Wouter J. H.; Wagemaker, Marnix; Lafont, Ugo
  • Chemistry of Materials, Vol. 20, Issue 9
  • DOI: 10.1021/cm703376e

Extended Solid Solutions and Coherent Transformations in Nanoscale Olivine Cathodes
journal, February 2014

  • Ravnsbæk, D. B.; Xiang, K.; Xing, W.
  • Nano Letters, Vol. 14, Issue 3
  • DOI: 10.1021/nl404679t

Diffusion of Li-ions in rutile. An ab initio study
journal, February 2003


Photocatalytic materials: recent achievements and near future trends
journal, January 2014

  • Fresno, Fernando; Portela, Raquel; Suárez, Silvia
  • J. Mater. Chem. A, Vol. 2, Issue 9
  • DOI: 10.1039/C3TA13793G

First principles predictions for intercalation behaviour
journal, November 2004


Averting cracks caused by insertion reaction in lithium–ion batteries
journal, June 2010

  • Hu, Yuhang; Zhao, Xuanhe; Suo, Zhigang
  • Journal of Materials Research, Vol. 25, Issue 6
  • DOI: 10.1557/JMR.2010.0142

Empirical bond-strength–bond-length curves for oxides
journal, May 1973


Nonaqueous lithium/titanium dioxide cell
journal, February 1979


TiO2 photocatalysis and related surface phenomena
journal, December 2008


In situ TEM observation of the structural transformation of rutile TiO 2 nanowire during electrochemical lithiation
journal, January 2014

  • Kim, Sung Joo; Noh, Sun-Young; Kargar, Alireza
  • Chemical Communications, Vol. 50, Issue 69
  • DOI: 10.1039/C4CC04161E

Nanoengineering Titania for High Rate Lithium Storage: A Review
journal, February 2013


Lithium insertion in different TiO2 modifications
journal, September 1988


Structural Evolution of Disordered Li x V 2 O 5 Bronzes in V 2 O 5 Cathodes for Li-Ion Batteries
journal, December 2018


Fracture of Brittle Solids
book, January 2010


The AMPIX electrochemical cell: a versatile apparatus for in situ X-ray scattering and spectroscopic measurements
journal, November 2012

  • Borkiewicz, Olaf J.; Shyam, Badri; Wiaderek, Kamila M.
  • Journal of Applied Crystallography, Vol. 45, Issue 6
  • DOI: 10.1107/S0021889812042720

Green energy storage materials: Nanostructured TiO2 and Sn-based anodes for lithium-ion batteries
journal, January 2009

  • Deng, Da; Kim, Min Gyu; Lee, Jim Yang
  • Energy & Environmental Science, Vol. 2, Issue 8, p. 818-837
  • DOI: 10.1039/b823474d

Effect of Chemical Lithium Insertion into Rutile TiO 2 Nanorods
journal, July 2009

  • Vijayakumar, M.; Kerisit, Sebastien; Wang, Chongmin
  • The Journal of Physical Chemistry C, Vol. 113, Issue 32
  • DOI: 10.1021/jp904148z

Local order in sol-gel derived glassy TiO2
journal, May 1995

  • Antonioli, G.; Bersani, D.; Lottici, P. P.
  • Nuclear Instruments and Methods in Physics Research Section B: Beam Interactions with Materials and Atoms, Vol. 97, Issue 1-4
  • DOI: 10.1016/0168-583X(94)00390-4

Nanocrystalline Rutile TiO[sub 2] Electrode for High-Capacity and High-Rate Lithium Storage
journal, January 2007

  • Jiang, Chunhai; Honma, Itaru; Kudo, Tetsuichi
  • Electrochemical and Solid-State Letters, Vol. 10, Issue 5
  • DOI: 10.1149/1.2712041

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

Atomistic Simulation of the Structural, Thermodynamic, and Elastic Properties of Li 2 TiO 3
journal, October 2011

  • Murphy, Samuel T.; Zeller, Philippe; Chartier, Alain
  • The Journal of Physical Chemistry C, Vol. 115, Issue 44
  • DOI: 10.1021/jp204678c