Thermochemistry of cation disordered Li ion battery cathode materials, (M′ = Nb and Ta, M′′ = Mn and Fe)

Subramani, Tamilarasan; Navrotsky, Alexandra

doi:10.1039/C9RA09759G

Title: Thermochemistry of cation disordered Li ion battery cathode materials, (M′ = Nb and Ta, M′′ = Mn and Fe)

Abstract

Enthalpies of formation from oxides (Δ H _f,ox ) of novel disordered Li _1+x Ta _x Fe _1−2x O ₂ and reported (M′′ = Mn ³⁺ and Fe ³⁺ ).

Authors:

Subramani, Tamilarasan ^[1];

^[1]

Peter A. Rock Thermochemistry Laboratory, NEAT ORU, University of California, Davis, USA

Publication Date:: 2020-02-12

Research Org.:: Univ. of California, Davis, CA (United States)

Sponsoring Org.:: USDOE Office of Science (SC)

OSTI Identifier:: 1599253

Alternate Identifier(s):: OSTI ID: 1800119

Grant/Contract Number:: FG02-03ER46053

Resource Type:: Published Article

Journal Name:: RSC Advances

Additional Journal Information:: Journal Name: RSC Advances Journal Volume: 10 Journal Issue: 11; Journal ID: ISSN 2046-2069

Publisher:: Royal Society of Chemistry (RSC)

Country of Publication:: United Kingdom

Language:: English

Subject:: 37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CHEMISTRY; Chemistry

Citation Formats


                    Subramani, Tamilarasan, and Navrotsky, Alexandra. Thermochemistry of cation disordered Li ion battery cathode materials, (M′ = Nb and Ta, M′′ = Mn and Fe).  United Kingdom: N. p., 2020. 
Web.  doi:10.1039/C9RA09759G.

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                    Subramani, Tamilarasan, & Navrotsky, Alexandra. Thermochemistry of cation disordered Li ion battery cathode materials, (M′ = Nb and Ta, M′′ = Mn and Fe).  United Kingdom.  https://doi.org/10.1039/C9RA09759G

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                    Subramani, Tamilarasan, and Navrotsky, Alexandra. Wed .  
"Thermochemistry of cation disordered Li ion battery cathode materials, (M′ = Nb and Ta, M′′ = Mn and Fe)".  United Kingdom.  https://doi.org/10.1039/C9RA09759G.

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@article{osti_1599253,

  title        = {Thermochemistry of cation disordered Li ion battery cathode materials, (M′ = Nb and Ta, M′′ = Mn and Fe)},

  author       = {Subramani, Tamilarasan and Navrotsky, Alexandra},

  abstractNote = {Enthalpies of formation from oxides (Δ H f,ox ) of novel disordered Li 1+x Ta x Fe 1−2x O 2 and reported (M′′ = Mn 3+ and Fe 3+ ).},

  doi          = {10.1039/C9RA09759G},

  journal      = {RSC Advances},

  number       = 11,

  volume       = 10,

  place        = {United Kingdom},

  year         = {2020},

  month        = {2}

}

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Title: Thermochemistry of cation disordered Li ion battery cathode materials, (M′ = Nb and Ta, M′′ = Mn and Fe)

Abstract

Citation Formats

Stabilizing Effect of Mg on the Energetics of the Li(Ni,Co,Al)O 2 Cathode Material for Lithium Ion Batteries journal, December 2012

Double-slit photoelectron interference in strong-field ionization of the neon dimer journal, January 2019

Die Kristallstruktur von Li2SnO3 journal, January 1971

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Revised effective ionic radii and systematic studies of interatomic distances in halides and chalcogenides journal, September 1976

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The thermodynamics of cation distributions in simple spinels journal, November 1967

Electrodes with High Power and High Capacity for Rechargeable Lithium Batteries journal, February 2006

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Mineralogy, materials science, energy, and environment: A 2015 perspective journal, April 2015

Enthalpy of Formation of Li[sub x]CoO[sub 2] (0.5 ≤ x ≤ 1.0) journal, January 2005

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GSAS-II : the genesis of a modern open-source all purpose crystallography software package journal, March 2013

Structure and bonding in lithium ruthenate, Li2RuO3 journal, June 1988

Understanding the Effect of Local Short-Range Ordering on Lithium Diffusion in Li1.3Nb0.3Mn0.4O2 Single-Crystal Cathode journal, September 2018

Unlocking the Potential of Cation-Disordered Oxides for Rechargeable Lithium Batteries journal, January 2014

VESTA 3 for three-dimensional visualization of crystal, volumetric and morphology data journal, October 2011

Identifying the redox activity of cation-disordered Li–Fe–V–Ti oxide cathodes for Li-ion batteries journal, January 2016

Fine Li(4 ? x)/3Ti(2 ? 2x)/3FexO2 (0.18 ? x ? 0.67) powder with cubic rock-salt structure as a positive electrode material for rechargeable lithium batteries journal, January 2003

Synthesis and electrochemical properties of Li 1.3 Nb 0.3 V 0.4 O 2 as a positive electrode material for rechargeable lithium batteries journal, January 2016

Progress and new directions in high temperature calorimetry journal, January 1977

Design principles for high transition metal capacity in disordered rocksalt Li-ion cathodes journal, January 2018

Progress and New Directions in Calorimetry: A 2014 Perspective journal, October 2014

Crystal growth and structure refinement of monoclinic Li2TiO3 journal, January 2009

The Configurational Space of Rocksalt-Type Oxides for High-Capacity Lithium Battery Electrodes journal, May 2014

LiMO2 (M=Mn, Fe, and Co): Energetics, polymorphism and phase transformation journal, April 2005

Progress and new directions in high temperature calorimetry revisited journal, April 1997

High-capacity electrode materials for rechargeable lithium batteries: Li 3 NbO 4 -based system with cation-disordered rocksalt structure journal, June 2015

Thermochemistry of Li1+xMn2−xO4 (0⩽x⩽1/3) spinel journal, April 2005

A new class of high capacity cation-disordered oxides for rechargeable lithium batteries: Li–Ni–Ti–Mo oxides journal, January 2015

Evolution of Local Structural Ordering and Chemical Distribution upon Delithiation of a Rock Salt–Structured Li 1.3 Ta 0.3 Mn 0.4 O 2 Cathode journal, February 2019

Lithium Extraction and Insertion Behavior of Nanocrystalline Li[sub 2]TiO[sub 3]-LiFeO[sub 2] Solid Solution with Cubic Rock Salt Structure journal, January 2003

Stabilizing Effect of Mg on the Energetics of the Li(Ni,Co,Al)O ₂ Cathode Material for Lithium Ion Batteries
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Double-slit photoelectron interference in strong-field ionization of the neon dimer
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Die Kristallstruktur von Li2SnO3
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Challenges for Rechargeable Li Batteries
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Lithium Batteries and Cathode Materials
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Mitigating oxygen loss to improve the cycling performance of high capacity cation-disordered cathode materials
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Enthalpy of formation of Li1+xMn2−xO4 (0<x<0.1) spinel phases
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Revised effective ionic radii and systematic studies of interatomic distances in halides and chalcogenides
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Lithium manganese oxyfluoride as a new cathode material exhibiting oxygen redox
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The thermodynamics of cation distributions in simple spinels
journal, November 1967

Electrodes with High Power and High Capacity for Rechargeable Lithium Batteries
journal, February 2006

Unravelling Solid-State Redox Chemistry in Li _1.3 Nb _0.3 Mn _0.4 O ₂ Single-Crystal Cathode Material
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Magnetic Properties of Metastable Lithium Iron Oxides Obtained by Solvothermal/Hydrothermal Reaction
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Enthalpy of formation of LiNiO2, LiCoO2 and their solid solution, LiNi1−xCoxO2
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Mineralogy, materials science, energy, and environment: A 2015 perspective
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Enthalpy of Formation of Li[sub x]CoO[sub 2] (0.5 ≤ x ≤ 1.0)
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Improvement of Cathode Properties by Lithium Excess in Disordered Rocksalt Li<sub>2+2</sub><i><sub>x</sub></i>Mn<sub>1−</sub><i><sub>x</sub></i>Ti<sub>1−</sub><i><sub>x</sub></i>O<sub>4</sub>
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GSAS-II : the genesis of a modern open-source all purpose crystallography software package
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Structure and bonding in lithium ruthenate, Li2RuO3
journal, June 1988

Understanding the Effect of Local Short-Range Ordering on Lithium Diffusion in Li1.3Nb0.3Mn0.4O2 Single-Crystal Cathode
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Unlocking the Potential of Cation-Disordered Oxides for Rechargeable Lithium Batteries
journal, January 2014

VESTA 3 for three-dimensional visualization of crystal, volumetric and morphology data
journal, October 2011

Identifying the redox activity of cation-disordered Li–Fe–V–Ti oxide cathodes for Li-ion batteries
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Fine Li(4 ? x)/3Ti(2 ? 2x)/3FexO2 (0.18 ? x ? 0.67) powder with cubic rock-salt structure as a positive electrode material for rechargeable lithium batteries
journal, January 2003

Synthesis and electrochemical properties of Li _1.3 Nb _0.3 V _0.4 O ₂ as a positive electrode material for rechargeable lithium batteries
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Progress and new directions in high temperature calorimetry
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Design principles for high transition metal capacity in disordered rocksalt Li-ion cathodes
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Progress and New Directions in Calorimetry: A 2014 Perspective
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Crystal growth and structure refinement of monoclinic Li2TiO3
journal, January 2009

The Configurational Space of Rocksalt-Type Oxides for High-Capacity Lithium Battery Electrodes
journal, May 2014

LiMO₂ (M=Mn, Fe, and Co): Energetics, polymorphism and phase transformation
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Progress and new directions in high temperature calorimetry revisited
journal, April 1997

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journal, June 2015

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journal, April 2005

A new class of high capacity cation-disordered oxides for rechargeable lithium batteries: Li–Ni–Ti–Mo oxides
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