Spontaneous aggregation of lithium ion coordination polymers in fluorinated electrolytes for high-voltage batteries

Malliakas, Christos D.; Leung, Kevin; Pupek, Krzysztof Z.; Shkrob, Ilya A.; Abraham, Daniel P.

doi:10.1039/c6cp01157h

Title: Spontaneous aggregation of lithium ion coordination polymers in fluorinated electrolytes for high-voltage batteries

Abstract

Fluorinated carbonate solvents are pursued as liquid electrolytes for high-voltage Li-ion batteries. We report aggregation of [Li⁺(FEC)₃]_n polymer species from fluoroethylene carbonate containing electrolytes and scrutinized the causes for this behavior.

Authors:

Malliakas, Christos D. ^[1]; Leung, Kevin ^[2]; Pupek, Krzysztof Z. ^[3]; Shkrob, Ilya A. ^[3]; Abraham, Daniel P. ^[3]

Argonne National Lab. (ANL), Argonne, IL (United States); Northwestern Univ., Evanston, IL (United States)
Sandia National Lab. (SNL-NM), Albuquerque, NM (United States)
Argonne National Lab. (ANL), Argonne, IL (United States)

Publication Date:: Thu Mar 31 00:00:00 EDT 2016

Research Org.:: Sandia National Lab. (SNL-NM), Albuquerque, NM (United States)

Sponsoring Org.:: USDOE National Nuclear Security Administration (NNSA); USDOE Office of Science (SC), Basic Energy Sciences (BES)

OSTI Identifier:: 1249078

Report Number(s):: SAND-2016-1267J
Journal ID: ISSN 1463-9076; PPCPFQ; 619516

Grant/Contract Number:: AC04-94AL85000; SC0001160; AC02-06CH11357

Resource Type:: Accepted Manuscript

Journal Name:: Physical Chemistry Chemical Physics. PCCP

Additional Journal Information:: Journal Volume: 18; Journal Issue: 16; Journal ID: ISSN 1463-9076

Publisher:: Royal Society of Chemistry

Country of Publication:: United States

Language:: English

Subject:: 25 ENERGY STORAGE

Citation Formats


                    Malliakas, Christos D., Leung, Kevin, Pupek, Krzysztof Z., Shkrob, Ilya A., and Abraham, Daniel P. Spontaneous aggregation of lithium ion coordination polymers in fluorinated electrolytes for high-voltage batteries.  United States: N. p., 2016. 
Web.  doi:10.1039/c6cp01157h.

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                    Malliakas, Christos D., Leung, Kevin, Pupek, Krzysztof Z., Shkrob, Ilya A., & Abraham, Daniel P. Spontaneous aggregation of lithium ion coordination polymers in fluorinated electrolytes for high-voltage batteries.  United States.  https://doi.org/10.1039/c6cp01157h

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                    Malliakas, Christos D., Leung, Kevin, Pupek, Krzysztof Z., Shkrob, Ilya A., and Abraham, Daniel P. Thu .  
"Spontaneous aggregation of lithium ion coordination polymers in fluorinated electrolytes for high-voltage batteries".  United States.  https://doi.org/10.1039/c6cp01157h.  https://www.osti.gov/servlets/purl/1249078.

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@article{osti_1249078,

  title        = {Spontaneous aggregation of lithium ion coordination polymers in fluorinated electrolytes for high-voltage batteries},

  author       = {Malliakas, Christos D. and Leung, Kevin and Pupek, Krzysztof Z. and Shkrob, Ilya A. and Abraham, Daniel P.},

  abstractNote = {Fluorinated carbonate solvents are pursued as liquid electrolytes for high-voltage Li-ion batteries. We report aggregation of [Li+(FEC)3]n polymer species from fluoroethylene carbonate containing electrolytes and scrutinized the causes for this behavior.},

  doi          = {10.1039/c6cp01157h},

  journal      = {Physical Chemistry Chemical Physics. PCCP},

  number       = 16,

  volume       = 18,

  place        = {United States},

  year         = {Thu Mar 31 00:00:00 EDT 2016},

  month        = {Thu Mar 31 00:00:00 EDT 2016}

}

Copy to clipboard

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https://doi.org/10.1039/c6cp01157h

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Works referenced in this record:

Solvate Structures and Computational/Spectroscopic Characterization of LiPF ₆ Electrolytes
journal, April 2015

Han, Sang-Don; Yun, Sung-Hyun; Borodin, Oleg
The Journal of Physical Chemistry C, Vol. 119, Issue 16
DOI: 10.1021/acs.jpcc.5b00826

X-Ray absorption spectroscopy of LiBF ₄ in propylene carbonate: a model lithium ion battery electrolyte
journal, January 2014

Smith, Jacob W.; Lam, Royce K.; Sheardy, Alex T.
Phys. Chem. Chem. Phys., Vol. 16, Issue 43
DOI: 10.1039/C4CP03240C

Quantum Chemistry and Molecular Dynamics Simulation Study of Dimethyl Carbonate: Ethylene Carbonate Electrolytes Doped with LiPF ₆
journal, February 2009

Borodin, Oleg; Smith, Grant D.
The Journal of Physical Chemistry B, Vol. 113, Issue 6
DOI: 10.1021/jp809614h

Solvate Structures and Spectroscopic Characterization of LiTFSI Electrolytes
journal, September 2014

Seo, Daniel M.; Boyle, Paul D.; Sommer, Roger D.
The Journal of Physical Chemistry B, Vol. 118, Issue 47
DOI: 10.1021/jp505006x

A Combined Theoretical and Experimental Study of the Influence of Different Anion Ratios on Lithium Ion Dynamics in Ionic Liquids
journal, June 2014

Lesch, Volker; Jeremias, Sebastian; Moretti, Arianna
The Journal of Physical Chemistry B, Vol. 118, Issue 26
DOI: 10.1021/jp501075g

Concentrated electrolytes: decrypting electrolyte properties and reassessing Al corrosion mechanisms
journal, January 2014

McOwen, Dennis W.; Seo, Daniel M.; Borodin, Oleg
Energy Environ. Sci., Vol. 7, Issue 1
DOI: 10.1039/C3EE42351D

LiTFSI Structure and Transport in Ethylene Carbonate from Molecular Dynamics Simulations
journal, March 2006

Borodin, Oleg; Smith, Grant D.
The Journal of Physical Chemistry B, Vol. 110, Issue 10
DOI: 10.1021/jp056249q

Role of Mixed Solvation and Ion Pairing in the Solution Structure of Lithium Ion Battery Electrolytes
journal, June 2015

Seo, Daniel M.; Reininger, Stefanie; Kutcher, Mary
The Journal of Physical Chemistry C, Vol. 119, Issue 25
DOI: 10.1021/acs.jpcc.5b03694

Natural abundance 17O, 6Li NMR and molecular modeling studies of the solvation structures of lithium bis(fluorosulfonyl)imide/1,2-dimethoxyethane liquid electrolytes
journal, March 2016

Wan, Chuan; Hu, Mary Y.; Borodin, Oleg
Journal of Power Sources, Vol. 307
DOI: 10.1016/j.jpowsour.2015.12.120

Structural chemistry of new lithium bis(oxalato)borate solvates
journal, November 2004

Zavalij, Peter Y.; Yang, Shoufeng; Whittingham, M. Stanley
Acta Crystallographica Section B Structural Science, Vol. 60, Issue 6
DOI: 10.1107/S0108768104022153

Fluorinated Electrolytes for 5-V Li-Ion Chemistry: Probing Voltage Stability of Electrolytes with Electrochemical Floating Test
journal, January 2015

He, Meinan; Hu, Libo; Xue, Zheng
Journal of The Electrochemical Society, Vol. 162, Issue 9
DOI: 10.1149/2.0231509jes

Lithium Ion Solvation and Diffusion in Bulk Organic Electrolytes from First-Principles and Classical Reactive Molecular Dynamics
journal, January 2015

Ong, Mitchell T.; Verners, Osvalds; Draeger, Erik W.
The Journal of Physical Chemistry B, Vol. 119, Issue 4
DOI: 10.1021/jp508184f

What Makes Fluoroethylene Carbonate Different?
journal, June 2015

Shkrob, Ilya A.; Wishart, James F.; Abraham, Daniel P.
The Journal of Physical Chemistry C, Vol. 119, Issue 27
DOI: 10.1021/acs.jpcc.5b03591

Solvation Structure around the Li ⁺ Ion in Mixed Cyclic/Linear Carbonate Solutions Unveiled by the Raman Noncoincidence Effect
journal, July 2015

Giorgini, Maria Grazia; Futamatagawa, Kazuma; Torii, Hajime
The Journal of Physical Chemistry Letters, Vol. 6, Issue 16
DOI: 10.1021/acs.jpclett.5b01524

Crystal structure and physical properties of lithium difluoro(oxalato)borate (LiDFOB or LiBF2Ox)
journal, November 2011

Allen, Joshua L.; Han, Sang-Don; Boyle, Paul D.
Journal of Power Sources, Vol. 196, Issue 22
DOI: 10.1016/j.jpowsour.2011.07.065

Fluorinated electrolytes for 5 V lithium-ion battery chemistry
journal, January 2013

Zhang, Zhengcheng; Hu, Libo; Wu, Huiming
Energy & Environmental Science, Vol. 6, Issue 6
DOI: 10.1039/c3ee24414h

Local structure of Li+ in concentrated LiPF6–dimethyl carbonate solutions
journal, May 2016

Kameda, Yasuo; Saito, Soshi; Umebayashi, Yasuhiro
Journal of Molecular Liquids, Vol. 217
DOI: 10.1016/j.molliq.2015.07.004

Competitive lithium solvation of linear and cyclic carbonates from quantum chemistry
journal, January 2016

Borodin, Oleg; Olguin, Marco; Ganesh, P.
Physical Chemistry Chemical Physics, Vol. 18, Issue 1
DOI: 10.1039/C5CP05121E

Nonaqueous Liquid Electrolytes for Lithium-Based Rechargeable Batteries
journal, October 2004

Xu, Kang
Chemical Reviews, Vol. 104, Issue 10, p. 4303-4418
DOI: 10.1021/cr030203g

Molecular Dynamics Simulation Studies of the Structure of a Mixed Carbonate/LiPF ₆ Electrolyte near Graphite Surface as a Function of Electrode Potential
journal, December 2011

Vatamanu, Jenel; Borodin, Oleg; Smith, Grant D.
The Journal of Physical Chemistry C, Vol. 116, Issue 1
DOI: 10.1021/jp2101539

Role of Solution Structure in Solid Electrolyte Interphase Formation on Graphite with LiPF ₆ in Propylene Carbonate
journal, November 2013

Nie, Mengyun; Abraham, Daniel P.; Seo, Daniel M.
The Journal of Physical Chemistry C, Vol. 117, Issue 48
DOI: 10.1021/jp409765w

Investigation of solvation in lithium ion battery electrolytes by NMR spectroscopy
journal, July 2010

Yang, Li; Xiao, Ang; Lucht, Brett L.
Journal of Molecular Liquids, Vol. 154, Issue 2-3
DOI: 10.1016/j.molliq.2010.04.025

New substantially fluorinated ionomers for electrochemical applications
journal, August 2004

Bekiarian, Paul G.; Doyle, Marc; Farnham, William B.
Journal of Fluorine Chemistry, Vol. 125, Issue 8
DOI: 10.1016/j.jfluchem.2004.05.007

Li ⁺ -solvation/desolvation dictates interphasial processes on graphitic anode in Li ion cells
journal, August 2012

Xu, Kang; von Wald Cresce, Arthur
Journal of Materials Research, Vol. 27, Issue 18
DOI: 10.1557/jmr.2012.104

Fluoroethylene Carbonate as an Important Component in Electrolyte Solutions for High-Voltage Lithium Batteries: Role of Surface Chemistry on the Cathode
journal, June 2014

Markevich, Elena; Salitra, Gregory; Fridman, Katia
Langmuir, Vol. 30, Issue 25
DOI: 10.1021/la501368y

Preferential Solvation of Li+ Directs Formation of Interphase on Graphitic Anode
journal, January 2011

von Cresce, Arthur; Xu, Kang
Electrochemical and Solid-State Letters, Vol. 14, Issue 10
DOI: 10.1149/1.3615828

The Effect of Fluoroethylene Carbonate as an Additive on the Solid Electrolyte Interphase on Silicon Lithium-Ion Electrodes
journal, August 2015

Schroder, Kjell; Alvarado, Judith; Yersak, Thomas A.
Chemistry of Materials, Vol. 27, Issue 16
DOI: 10.1021/acs.chemmater.5b01627

Towards high throughput screening of electrochemical stability of battery electrolytes
journal, August 2015

Borodin, Oleg; Olguin, Marco; Spear, Carrie E.
Nanotechnology, Vol. 26, Issue 35
DOI: 10.1088/0957-4484/26/35/354003

Understanding Li ⁺ –Solvent Interaction in Nonaqueous Carbonate Electrolytes with ¹⁷ O NMR
journal, May 2013

Bogle, Xavier; Vazquez, Rafael; Greenbaum, Steven
The Journal of Physical Chemistry Letters, Vol. 4, Issue 10
DOI: 10.1021/jz400661k

Nonaqueous Liquid Electrolytes for Lithium-Based Rechargeable Batteries
journal, December 2004

Xu, Kang
ChemInform, Vol. 35, Issue 50
DOI: 10.1002/chin.200450271

A combined theoretical and experimental study of the influence of different anion ratios on lithium ion dynamics in ionic liquids
preprint, January 2014

Lesch, Volker; Jeremias, Sebastian; Moretti, Arianna
arXiv
DOI: 10.48550/arxiv.1401.7924

Works referencing / citing this record:

Recent progress in metal–organic polymers as promising electrodes for lithium/sodium rechargeable batteries
journal, January 2019

Wu, Zhenzhen; Xie, Jian; Xu, Zhichuan J.
Journal of Materials Chemistry A, Vol. 7, Issue 9
DOI: 10.1039/c8ta11994e

Layered Oxide, Graphite and Silicon-Graphite Electrodes for Lithium-Ion Cells: Effect of Electrolyte Composition and Cycling Windows
journal, October 2016

Klett, Matilda; Gilbert, James A.; Pupek, Krzysztof Z.
Journal of The Electrochemical Society, Vol. 164, Issue 1
DOI: 10.1149/2.0131701jes

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Title: Spontaneous aggregation of lithium ion coordination polymers in fluorinated electrolytes for high-voltage batteries

Abstract

Citation Formats

Solvate Structures and Computational/Spectroscopic Characterization of LiPF 6 Electrolytes journal, April 2015

X-Ray absorption spectroscopy of LiBF 4 in propylene carbonate: a model lithium ion battery electrolyte journal, January 2014

Quantum Chemistry and Molecular Dynamics Simulation Study of Dimethyl Carbonate: Ethylene Carbonate Electrolytes Doped with LiPF 6 journal, February 2009

Solvate Structures and Spectroscopic Characterization of LiTFSI Electrolytes journal, September 2014

A Combined Theoretical and Experimental Study of the Influence of Different Anion Ratios on Lithium Ion Dynamics in Ionic Liquids journal, June 2014

Concentrated electrolytes: decrypting electrolyte properties and reassessing Al corrosion mechanisms journal, January 2014

LiTFSI Structure and Transport in Ethylene Carbonate from Molecular Dynamics Simulations journal, March 2006

Role of Mixed Solvation and Ion Pairing in the Solution Structure of Lithium Ion Battery Electrolytes journal, June 2015

Natural abundance 17O, 6Li NMR and molecular modeling studies of the solvation structures of lithium bis(fluorosulfonyl)imide/1,2-dimethoxyethane liquid electrolytes journal, March 2016

Structural chemistry of new lithium bis(oxalato)borate solvates journal, November 2004

Fluorinated Electrolytes for 5-V Li-Ion Chemistry: Probing Voltage Stability of Electrolytes with Electrochemical Floating Test journal, January 2015

Lithium Ion Solvation and Diffusion in Bulk Organic Electrolytes from First-Principles and Classical Reactive Molecular Dynamics journal, January 2015

What Makes Fluoroethylene Carbonate Different? journal, June 2015

Solvation Structure around the Li + Ion in Mixed Cyclic/Linear Carbonate Solutions Unveiled by the Raman Noncoincidence Effect journal, July 2015

Crystal structure and physical properties of lithium difluoro(oxalato)borate (LiDFOB or LiBF2Ox) journal, November 2011

Fluorinated electrolytes for 5 V lithium-ion battery chemistry journal, January 2013

Local structure of Li+ in concentrated LiPF6–dimethyl carbonate solutions journal, May 2016

Competitive lithium solvation of linear and cyclic carbonates from quantum chemistry journal, January 2016

Nonaqueous Liquid Electrolytes for Lithium-Based Rechargeable Batteries journal, October 2004

Molecular Dynamics Simulation Studies of the Structure of a Mixed Carbonate/LiPF 6 Electrolyte near Graphite Surface as a Function of Electrode Potential journal, December 2011

Role of Solution Structure in Solid Electrolyte Interphase Formation on Graphite with LiPF 6 in Propylene Carbonate journal, November 2013

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Fluoroethylene Carbonate as an Important Component in Electrolyte Solutions for High-Voltage Lithium Batteries: Role of Surface Chemistry on the Cathode journal, June 2014

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The Effect of Fluoroethylene Carbonate as an Additive on the Solid Electrolyte Interphase on Silicon Lithium-Ion Electrodes journal, August 2015

Towards high throughput screening of electrochemical stability of battery electrolytes journal, August 2015

Understanding Li + –Solvent Interaction in Nonaqueous Carbonate Electrolytes with 17 O NMR journal, May 2013

Nonaqueous Liquid Electrolytes for Lithium-Based Rechargeable Batteries journal, December 2004

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Recent progress in metal–organic polymers as promising electrodes for lithium/sodium rechargeable batteries journal, January 2019

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Solvate Structures and Computational/Spectroscopic Characterization of LiPF ₆ Electrolytes
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X-Ray absorption spectroscopy of LiBF ₄ in propylene carbonate: a model lithium ion battery electrolyte
journal, January 2014

Quantum Chemistry and Molecular Dynamics Simulation Study of Dimethyl Carbonate: Ethylene Carbonate Electrolytes Doped with LiPF ₆
journal, February 2009

Solvate Structures and Spectroscopic Characterization of LiTFSI Electrolytes
journal, September 2014

A Combined Theoretical and Experimental Study of the Influence of Different Anion Ratios on Lithium Ion Dynamics in Ionic Liquids
journal, June 2014

Concentrated electrolytes: decrypting electrolyte properties and reassessing Al corrosion mechanisms
journal, January 2014

LiTFSI Structure and Transport in Ethylene Carbonate from Molecular Dynamics Simulations
journal, March 2006

Role of Mixed Solvation and Ion Pairing in the Solution Structure of Lithium Ion Battery Electrolytes
journal, June 2015

Natural abundance 17O, 6Li NMR and molecular modeling studies of the solvation structures of lithium bis(fluorosulfonyl)imide/1,2-dimethoxyethane liquid electrolytes
journal, March 2016

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journal, November 2004

Fluorinated Electrolytes for 5-V Li-Ion Chemistry: Probing Voltage Stability of Electrolytes with Electrochemical Floating Test
journal, January 2015

Lithium Ion Solvation and Diffusion in Bulk Organic Electrolytes from First-Principles and Classical Reactive Molecular Dynamics
journal, January 2015

What Makes Fluoroethylene Carbonate Different?
journal, June 2015

Solvation Structure around the Li ⁺ Ion in Mixed Cyclic/Linear Carbonate Solutions Unveiled by the Raman Noncoincidence Effect
journal, July 2015

Crystal structure and physical properties of lithium difluoro(oxalato)borate (LiDFOB or LiBF2Ox)
journal, November 2011

Fluorinated electrolytes for 5 V lithium-ion battery chemistry
journal, January 2013

Local structure of Li+ in concentrated LiPF6–dimethyl carbonate solutions
journal, May 2016

Competitive lithium solvation of linear and cyclic carbonates from quantum chemistry
journal, January 2016

Nonaqueous Liquid Electrolytes for Lithium-Based Rechargeable Batteries
journal, October 2004

Molecular Dynamics Simulation Studies of the Structure of a Mixed Carbonate/LiPF ₆ Electrolyte near Graphite Surface as a Function of Electrode Potential
journal, December 2011

Role of Solution Structure in Solid Electrolyte Interphase Formation on Graphite with LiPF ₆ in Propylene Carbonate
journal, November 2013

Investigation of solvation in lithium ion battery electrolytes by NMR spectroscopy
journal, July 2010

New substantially fluorinated ionomers for electrochemical applications
journal, August 2004

Li ⁺ -solvation/desolvation dictates interphasial processes on graphitic anode in Li ion cells
journal, August 2012

Fluoroethylene Carbonate as an Important Component in Electrolyte Solutions for High-Voltage Lithium Batteries: Role of Surface Chemistry on the Cathode
journal, June 2014

Preferential Solvation of Li+ Directs Formation of Interphase on Graphitic Anode
journal, January 2011

The Effect of Fluoroethylene Carbonate as an Additive on the Solid Electrolyte Interphase on Silicon Lithium-Ion Electrodes
journal, August 2015

Towards high throughput screening of electrochemical stability of battery electrolytes
journal, August 2015

Understanding Li ⁺ –Solvent Interaction in Nonaqueous Carbonate Electrolytes with ¹⁷ O NMR
journal, May 2013

Nonaqueous Liquid Electrolytes for Lithium-Based Rechargeable Batteries
journal, December 2004

A combined theoretical and experimental study of the influence of different anion ratios on lithium ion dynamics in ionic liquids
preprint, January 2014

Recent progress in metal–organic polymers as promising electrodes for lithium/sodium rechargeable batteries
journal, January 2019

Layered Oxide, Graphite and Silicon-Graphite Electrodes for Lithium-Ion Cells: Effect of Electrolyte Composition and Cycling Windows
journal, October 2016