Improved Capacity Retention for LiVO[subscript 2] by Cr Substitution

We present a layered Li-intercalation oxide that operates on the V[superscript 3+]/V[superscript 4+] redox couple. The stabilization effect of adding a +3 element into the layered LiVO[subscript 2] has been studied by first principles calculations. We identified Cr substitution into LiVO[subscript 2...

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Main Authors: Ma, Xiaohua, Hautier, Geoffroy, Jain, Anubhav, Doe, Robert E., Ceder, Gerbrand
Other Authors: Massachusetts Institute of Technology. Department of Electrical Engineering and Computer Science
Format: Article
Language:en_US
Published: Electrochemical Society 2013
Online Access:http://hdl.handle.net/1721.1/82519
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author Ma, Xiaohua
Hautier, Geoffroy
Jain, Anubhav
Doe, Robert E.
Ceder, Gerbrand
author2 Massachusetts Institute of Technology. Department of Electrical Engineering and Computer Science
author_facet Massachusetts Institute of Technology. Department of Electrical Engineering and Computer Science
Ma, Xiaohua
Hautier, Geoffroy
Jain, Anubhav
Doe, Robert E.
Ceder, Gerbrand
author_sort Ma, Xiaohua
collection MIT
description We present a layered Li-intercalation oxide that operates on the V[superscript 3+]/V[superscript 4+] redox couple. The stabilization effect of adding a +3 element into the layered LiVO[subscript 2] has been studied by first principles calculations. We identified Cr substitution into LiVO[subscript 2] to be promising for stabilizing a layered material based on the V redox couple. Layered LiCr[subscript x]V[subscript 1-x]O2 (x = 0.1, 0.2, 0.4, 0.5) has been synthesized and tested electrochemically. The improved capacity retention confirms that the structural stability of delithiated LiVO[subscript 2] is improved by Cr doping.
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spelling mit-1721.1/825192022-10-01T10:21:01Z Improved Capacity Retention for LiVO[subscript 2] by Cr Substitution Improved Capacity Retention for LiVO2 by Cr Substitution Ma, Xiaohua Hautier, Geoffroy Jain, Anubhav Doe, Robert E. Ceder, Gerbrand Massachusetts Institute of Technology. Department of Electrical Engineering and Computer Science Massachusetts Institute of Technology. Department of Materials Science and Engineering Ma, Xiaohua Hautier, Geoffroy Jain, Anubhav Doe, Robert E. Ceder, Gerbrand We present a layered Li-intercalation oxide that operates on the V[superscript 3+]/V[superscript 4+] redox couple. The stabilization effect of adding a +3 element into the layered LiVO[subscript 2] has been studied by first principles calculations. We identified Cr substitution into LiVO[subscript 2] to be promising for stabilizing a layered material based on the V redox couple. Layered LiCr[subscript x]V[subscript 1-x]O2 (x = 0.1, 0.2, 0.4, 0.5) has been synthesized and tested electrochemically. The improved capacity retention confirms that the structural stability of delithiated LiVO[subscript 2] is improved by Cr doping. Robert Bosch GmbH Umicore Specialty Oxides and Chemicals 2013-11-20T20:41:09Z 2013-11-20T20:41:09Z 2012-12 2012-11 Article http://purl.org/eprint/type/JournalArticle 0013-4651 1945-7111 http://hdl.handle.net/1721.1/82519 Ma, X., G. Hautier, A. Jain, R. Doe, and G. Ceder. Improved Capacity Retention for LiVO2 by Cr Substitution. Journal of the Electrochemical Society 160, no. 2 (November 28, 2012): A279-A284. en_US http://dx.doi.org/10.1149/2.046302jes Journal of the Electrochemical Society Article is made available in accordance with the publisher's policy and may be subject to US copyright law. Please refer to the publisher's site for terms of use. application/pdf Electrochemical Society MIT web domain
spellingShingle Ma, Xiaohua
Hautier, Geoffroy
Jain, Anubhav
Doe, Robert E.
Ceder, Gerbrand
Improved Capacity Retention for LiVO[subscript 2] by Cr Substitution
title Improved Capacity Retention for LiVO[subscript 2] by Cr Substitution
title_full Improved Capacity Retention for LiVO[subscript 2] by Cr Substitution
title_fullStr Improved Capacity Retention for LiVO[subscript 2] by Cr Substitution
title_full_unstemmed Improved Capacity Retention for LiVO[subscript 2] by Cr Substitution
title_short Improved Capacity Retention for LiVO[subscript 2] by Cr Substitution
title_sort improved capacity retention for livo subscript 2 by cr substitution
url http://hdl.handle.net/1721.1/82519
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