Development and Application of New NMR Methods for Studying Interphases and Interfaces in Batteries

Información del proyecto

BATNMR

Identificador del acuerdo de subvención: 835073

DOI

10.3030/835073

Proyecto cerrado

Fecha de la firma de la CE 11 Junio 2019

Fecha de inicio 1 Octubre 2019

Fecha de finalización 30 Septiembre 2025

Financiado con arreglo a

• EXCELLENT SCIENCE - European Research Council (ERC)

Coste total

€ 3 498 219,00

Aportación de la UE

€ 3 498 219,00

Coordinado por

THE CHANCELLOR MASTERS AND SCHOLARS OF THE UNIVERSITY OF CAMBRIDGE
United Kingdom

CORDIS proporciona enlaces a los documentos públicos y las publicaciones de los proyectos de los programas marco HORIZONTE.

Los enlaces a los documentos y las publicaciones de los proyectos del Séptimo Programa Marco, así como los enlaces a algunos tipos de resultados específicos, como conjuntos de datos y «software», se obtienen dinámicamente de OpenAIRE .

Publicaciones

Peer reviewed articles (44)

Probing and Interpreting the Porosity and Tortuosity Evolution of Li-O 2 Cathodes on Discharge through a Combined Experimental and Theoretical Approach

Autores: Amangeldi Torayev, Simon Engelke, Zeliang Su, Lauren E. Marbella, Vincent De Andrade, Arnaud Demortière, Pieter C. M. M. Magusin, Céline Merlet, Alejandro A. Franco, and Clare P. Grey
Publicado en: The Journal of Physical Chemistry C, 2021, ISSN 1932-7447
Editor: American Chemical Society
DOI: 10.17863/cam.64888

Local Distortions and Dynamics in Hydrated Y-Doped BaZrO3.

Autores: Amangeldi Torayev; Luke Sperrin; Maria A. Gomez; John A. Kattirtzi; Céline Merlet; Céline Merlet; Céline Merlet; Clare P. Grey
Publicado en: Journal of Physical Chemistry C, Edición 1, 2021, ISSN 1932-7447
Editor: American Chemical Society
DOI: 10.17863/cam.54388

Identifying and preventing degradation in flavin mononucleotide-based redox flow batteries via NMR and EPR spectroscopy

Autores: Hey, Dominic; Jethwa, Rajesh B; Farag, Nadia L; Rinkel, Bernardine LD; Zhao, Evan Wenbo; Grey, Clare P
Publicado en: Nature Communications, 14, Edición 4, 2023, ISSN 2041-1723
Editor: Nature Publishing Group
DOI: 10.1038/s41467-023-40649-4

Probing and Interpreting the Porosity and Tortuosity Evolution of Li-O

Autores: Amangeldi, Torayev; Simon, Engelke; Zeliang, Su; Lauren E, Marbella; Vincent, De Andrade; Arnaud, Demortière; Pieter C M M, Magusin; Céline, Merlet; Alejandro A, Franco; Clare P, Grey
Publicado en: The Journal of Physical Chemistry. C, Nanomaterials and Interfaces, Edición 3, 2021, ISSN 1932-7447
Editor: American Chemical Society
DOI: 10.1021/acs.jpcc.0c10417

Selective NMR observation of the SEI–metal interface by dynamic nuclear polarisation from lithium metal

Autores: Michael A. Hope, Bernardine L. D. Rinkel, Anna B. Gunnarsdóttir, Katharina Märker, Svetlana Menkin, Subhradip Paul, Ivan V. Sergeyev, Clare P. Grey
Publicado en: Nature Communications, Edición 11/1, 2020, ISSN 2041-1723
Editor: Nature Publishing Group
DOI: 10.1038/s41467-020-16114-x

Local Distortions and Dynamics in Hydrated Y-Doped BaZrO 3

Autores: Amangeldi Torayev, Luke Sperrin, Maria A. Gomez, John A. Kattirtzi, Céline Merlet, Clare P. Grey
Publicado en: The Journal of Physical Chemistry C, Edición 124/30, 2020, Página(s) 16689-16701, ISSN 1932-7447
Editor: American Chemical Society
DOI: 10.1021/acs.jpcc.0c04594

Coordination of dissolved transition metals in pristine battery electrolyte solutions determined by NMR and EPR spectroscopy

Autores: Jennifer P. Allen, Conrad Szczuka, Holly E. Smith, Erlendur Jónsson, Rüdiger-A. Eichel, Josef Granwehr, Clare P. Grey
Publicado en: Physical Chemistry Chemical Physics, Edición 26, 2024, Página(s) 19505-19520, ISSN 1463-9076
Editor: Royal Society of Chemistry
DOI: 10.1039/d4cp01663g

Electrolyte oxidation pathways in lithium-ion batteries

Autores: Israel Temprano; Bernardine L. D. Rinkel; Clare P. Grey; David S. Hall
Publicado en: Journal of the American Chemical Society, Edición 1, 2020, ISSN 0002-7863
Editor: American Chemical Society
DOI: 10.17863/cam.59530

Operando monitoring of single-particle kineticstate-of-charge heterogeneities and cracking inhigh-rate Li-ion anodes

Autores: Merryweather, A. J., Jacquet, Q., Emge, S. P., Schnedermann, C., Rao, A., & Grey, C. P. (2022).
Publicado en: Nature Materials, 2022, ISSN 1476-1122
Editor: Nature Publishing Group
DOI: 10.1038/s41563-022-01324-z

Operando visualization of kinetically induced lithium heterogeneities in single-particle layered Ni-rich cathodes

Autores: C. Xu, A.J. Merryweather, S.S. Pandurangi, Z. Lun, D.S. Hall, V.S. Deshpande, N.A. Fleck, C. Schnedermann, A. Rao, C.P. Grey,
Publicado en: Joule, 2022, ISSN 2542-4351
Editor: Elsevier BV
DOI: 10.1016/j.joule.2022.09.008

Sodium Borates: Expanding the Electrolyte Selection for Sodium-Ion Batteries

Autores: Dr. Darren M. C. Ould, Dr. Svetlana Menkin, Holly E. Smith, Victor Riesgo-Gonzalez, Dr. Erlendur Jónsson, Dr. Christopher A. O'Keefe, Dr. Fazlil Coowar, Dr. Jerry Barker, Dr. Andrew D. Bond, Prof. Clare P. Grey, Prof. Dominic S. Wright
Publicado en: Agnew Chem Int. Ed. Engl., 2022, ISSN 1433-7851
Editor: John Wiley & Sons Ltd.
DOI: 10.1002/ange.202202133

Surface reduction in lithium- and manganese-rich layered cathodes for lithium ion batteries drives voltage decay.

Autores: Bo Wen; Farheen N. Sayed; Wesley M. Dose; Jędrzej K. Morzy; Yeonguk Son; Supreeth Nagendran; Caterina Ducati; Clare P. Grey; Michael F. L. De Volder
Publicado en: Journal of Materials Chemistry A, 2022, ISSN 2050-7488
Editor: Royal Society of Chemistry
DOI: 10.17863/cam.88809

Insights into soft short circuit-based degradation of lithium metal batteries

Autores: Svetlana Menkin; Jana B. Fritzke; Rebecca Larner; Cas de Leeuw; Yoonseong Choi; Anna B. Gunnarsdóttir; Clare P. Grey
Publicado en: Crossref, Edición 2, 2023, ISSN 1359-6640
Editor: Royal Society of Chemistry
DOI: 10.1039/d3fd00101f

Engineering considerations for practical lithium–air electrolytes

Autores: Ellison, James HJ; Grey, Clare P
Publicado en: Crossref, Edición 2, 2024, ISSN 1359-6640
Editor: Royal Society of Chemistry
DOI: 10.1039/d3fd00091e

Chemo-Mechanical Analysis of Lithiation/Delithiation of Ni-rich Single Crystals

Autores: S.S. Pandurangi, D.S. Hall, C.P. Grey, V.S. Deshpande, N.A. Fleck.
Publicado en: Journal of The Electrochemical Society, volume 170, 2023, ISSN 0013-4651
Editor: Electrochemical Society, Inc.
DOI: 10.1149/1945-7111/acd47e

On the Solvation of Redox Mediators and Implications for their Reactivity in Li-Air Batteries

Autores: Erlendur Jónsson, James H. J. Ellison, Evelyna Wang, Vera Kunz, Tao Liu, Israel Temprano, Clare P. Grey
Publicado en: Journal of The Electrochemical Society, Edición 168/3, 2021, Página(s) 030529, ISSN 0013-4651
Editor: Electrochemical Society, Inc.
DOI: 10.1149/1945-7111/abeb26

Graphite Anodes for Li-Ion Batteries: An Electron Paramagnetic Resonance Investigation

Autores: Insinna, Teresa; Bassey, Euan N; Märker, Katharina; Collauto, Alberto; Barra, Anne-Laure; Grey, Clare P
Publicado en: "Chemistry of Materials, 2023, 35 (14), pp.5497-5511. ⟨10.1021/acs.chemmater.3c00860⟩", Edición 3, 2023, ISSN 0897-4756
Editor: American Chemical Society
DOI: 10.1021/acs.chemmater.3c00860

Effect of Ionic Association in the Catalytic Mechanism of Redox Mediators for Li-air Batteries: a Theoretical Framework

Autores: Gabriela Horwitz, Vera Kunz, Samuel Niblett, Clare Grey
Publicado en: Phys Chem, Chem Phys, 2023, ISSN 1463-9076
Editor: Royal Society of Chemistry
DOI: 10.26434/chemrxiv-2023-17v6c

Unlocking Li superionic conductivity in face-centred cubic oxides via face-sharing configurations

Autores: Y. Chen, Z. Lun, X. Zhao, K.P. Koirala, L. Li, Y. Sun, C.A. O'Keefe, X. Yang, Z. Cai, C. Wang, H. Ji, C.P. Grey, B. Ouyang, G. Ceder
Publicado en: Nature Materials, 2024, ISSN 1932-7447
Editor: American Chemical Society
DOI: 10.1038/s41563-024-01800-8

Lithium Diffusion in Niobium Tungsten Oxide Shear Structures

Autores: Can P. Koçer, Kent J. Griffith, Clare P. Grey, Andrew J. Morris
Publicado en: Chemistry of Materials, Edición 32/9, 2020, Página(s) 3980-3989, ISSN 0897-4756
Editor: American Chemical Society
DOI: 10.1021/acs.chemmater.0c00483

Stabilized tilted-octahedra halide perovskites inhibit local formation of performance-limiting phases

Autores: By:Doherty, TAS (Doherty, Tiarnan A. S.) [1] ; Nagane, S (Nagane, Satyawan) [1] ; Kubicki, DJ (Kubicki, Dominik J.) [1] , [2] ; Jung, YK (Jung, Young-Kwang) [3] ; Johnstone, DN (Johnstone, Duncan N.) [4] ; Iqbal, AN (Iqbal, Affan N.) [1] , [5] ; Guo, DY (Guo, Dengyang) [1] , [5] ; Frohna, K (Frohna, Kyle) [1] ; Danaie, M (Danaie, Mohsen) [6] , [7] ; Tennyson, EM (Tennyson, Elizabeth M.) [1] ; Macp
Publicado en: Science, 2021, ISSN 0036-8075
Editor: American Association for the Advancement of Science
DOI: 10.1126/science.abl4890

Two electrolyte decomposition pathways at nickel-rich cathode surfaces in lithium-ion batteries.

Autores: Bernardine L. D. Rinkel; J. Padmanabhan Vivek; Nuria Garcia-Araez; Clare P. Grey
Publicado en: Energy and Environmental Sciences, Edición 1, 2022, ISSN 1754-5692
Editor: Royal Society of Chemistry
DOI: 10.17863/cam.86241

NMR Methodology for Measuring Dissolved O₂ and Transport in Lithium–Air Batteries

Autores: Wang, Evelyna; Jónsson, Erlendur; Grey, Clare P
Publicado en: Crossref, Edición 3, 2023, ISSN 1932-7447
Editor: American Chemical Society
DOI: 10.1021/acs.jpcc.3c00991

Clarifying the Dopant Local Structure and Effect on Ionic Conductivity in Garnet Solid-State Electrolytes for Lithium-Ion Batteries

Autores: Vema, Sundeep; Berge, Astrid H; Nagendran, Supreeth; Grey, Clare P
Publicado en: Crossref, Edición 2, 2023, ISSN 0897-4756
Editor: American Chemical Society
DOI: 10.1021/acs.chemmater.3c01831

Overhauser Dynamic Nuclear Polarization of Lithiated Graphite Anodes: Probing Bulk and Surface Structures

Autores: Teresa Insinna, Anne-Laure Barra, Clare P. Grey
Publicado en: Chemistry of Materials, Edición 37, 2025, Página(s) 5167-5182, ISSN 0897-4756
Editor: American Chemical Society
DOI: 10.1021/acs.chemmater.5c00845

Noninvasive In Situ NMR Study of “Dead Lithium” Formation and Lithium Corrosion in Full-Cell Lithium Metal Batteries

Autores: Anna B. Gunnarsdóttir, Chibueze V. Amanchukwu, Svetlana Menkin, Clare P. Grey
Publicado en: Journal of the American Chemical Society, Edición 142/49, 2020, Página(s) 20814-20827, ISSN 0002-7863
Editor: American Chemical Society
DOI: 10.1021/jacs.0c10258

Borates <i>vs</i>. aluminates: comparing the anion for lithium-ion batteries

Autores: Darren M. C. Ould, Megan E. Penrod, Jessica B. McConnell, Mohammed A. Zabara, Astrid H. Berge, Christopher A. O’Keefe, Andrew D. Bond, Svetlana Menkin, Clare P. Grey, Dominic S. Wright
Publicado en: Chemical Communications, Edición 61, 2024, Página(s) 129-132, ISSN 1359-7345
Editor: Royal Society of Chemistry
DOI: 10.1039/d4cc04812a

3D Nanocomposite Thin Film Cathodes for Micro‐Batteries with Enhanced High‐Rate Electrochemical Performance over Planar Films

Autores: Lovett, Adam J.; Daramalla, Venkateswarlu; Nayak, Debasis; Sayed, Farheen N.; Mahadevegowda, Amoghavarsha; Ducati, Caterina; Spencer, Ben F.; Dutton, Siân E.; Grey, Clare P.; MacManus‐Driscoll, Judith L.
Publicado en: Advanced Energy Materials, Edición 3, 2023, ISSN 1614-6832
Editor: Wiley-VCH Verlag
DOI: 10.1002/aenm.202302053

Sodium Tetrakis(hexafluoroisopropyloxy)aluminates: Synthesis and Electrochemical Characterisation of a Room‐Temperature Solvated Ionic Liquid

Autores: Darren M. C. Ould; Svetlana Menkin; Holly E. Smith; Víctor Riesgo‐González; Thomas H. Smith; Melissa N. B. Chinn; Erlendur Jónsson; Andrew D. Bond; Clare P. Grey; Dominic S. Wright
Publicado en: ChemElectroChem, Vol 11, Iss 2, Pp n/a-n/a (2024), Edición 3, 2024, ISSN 2196-0216
Editor: Wiley-VCH GmbH
DOI: 10.1002/celc.202300381

Probing the electrochemical behaviour of lithium imide as an electrolyte for solid-state batteries

Autores: Jeremy P. Lowen, Teresa Insinna, Tharigopala V. Beatriceveena, Mark P. Stockham, Bo Dong, Sarah J. Day, Clare P. Grey, Emma Kendrick, Peter R. Slater, Paul A. Anderson, Joshua W. Makepeace
Publicado en: EES Batteries, Edición 1, 2025, Página(s) 527-540, ISSN 3033-4071
Editor: Royal Society of Chemistry (RSC)
DOI: 10.1039/d5eb00058k

Associative pyridinium electrolytes for air-tolerant redox flow batteries

Autores: ME Carrington, K Sokołowski, E Jónsson, EW Zhao, AM Graf, I Temprano, JA McCune, CP Grey, OA Scherman,
Publicado en: Nature, 2024, ISSN 0028-0836
Editor: Nature Publishing Group
DOI: 10.1038/s41586-023-06664-7

Locating Impurity Phases in the Lithium-Ion Conductor Al-Doped Li₇La₃Zr₂O₁₂ through Dynamic Nuclear Polarization and Nuclear Magnetic Resonance Spectroscopy

Autores: Astrid H. Berge, Sundeep Vema, Christopher A. O’Keefe, Clare P. Grey
Publicado en: Chemistry of Materials, Edición 37, 2025, Página(s) 3842-3852, ISSN 0897-4756
Editor: American Chemical Society
DOI: 10.1021/acs.chemmater.5c00807

Spiers Memorial Lecture: Lithium air batteries – tracking function and failure

Autores: Fritzke, Jana B; Ellison, James HJ; Brazel, Laurence; Horwitz, Gabriela; Menkin, Svetlana; Grey, Clare P
Publicado en: Crossref, Edición 3, 2024, ISSN 1359-6640
Editor: Royal Society of Chemistry
DOI: 10.1039/d3fd00154g

Understanding the Surface Regeneration and Reactivity of Garnet Solid-State Electrolytes

Autores: Vema, Sundeep; Sayed, Farheen N; Nagendran, Supreeth; Karagoz, Burcu; Sternemann, Christian; Paulus, Michael; Held, Georg; Grey, Clare P
Publicado en: Crossref, Edición 2, 2023, ISSN 2380-8195
Editor: American Chemical Society
DOI: 10.1021/acsenergylett.3c01042

Strong Magnetic Exchange Interactions and Delocalized Mn–O States Enable High-Voltage Capacity in the Na-Ion Cathode P2–Na_0.67[Mg_0.28Mn_0.72]O₂

Autores: Euan N. Bassey, Howie Nguyen, Teresa Insinna, Jeongjae Lee, Anne-Laure Barra, Giannantonio Cibin, Peter Bencok, Raphaële J. Clément, Clare P. Grey
Publicado en: Chemistry of Materials, Edición 36, 2024, Página(s) 9493-9515, ISSN 0897-4756
Editor: American Chemical Society
DOI: 10.1021/acs.chemmater.4c01320

Interactions of Oxide Surfaces with Water Revealed with Solid-State NMR Spectroscopy

Autores: Junchao Chen, Michael A. Hope, Zhiye Lin, Meng Wang, Tao Liu, David M. Halat, Yujie Wen, Teng Chen, Xiaokang Ke, Pieter C. M. M. Magusin, Weiping Ding, Xifeng Xia, Xin-Ping Wu, Xue-Qing Gong, Clare P. Grey, Luming Peng
Publicado en: Journal of the American Chemical Society, Edición 142/25, 2020, Página(s) 11173-11182, ISSN 0002-7863
Editor: American Chemical Society
DOI: 10.1021/jacs.0c03760

Investigating the effect of a fluoroethylene carbonate additive on lithium deposition and the solid electrolyte interphase spectroscopy

Autores: Gunnarsdóttir, A., Vema, S., Menkin, S., Marbella, L., & Grey, C.
Publicado en: Journal of Materials Chemistry A, 2020, ISSN 2050-7488
Editor: Royal Society of Chemistry
DOI: 10.17863/cam.54707

Stable Hexylphosphonate-Capped Blue-Emitting Quantum-Confined CsPbBr 3 Nanoplatelets

Autores: Javad Shamsi, Dominik Kubicki, Miguel Anaya, Yun Liu, Kangyu Ji, Kyle Frohna, Clare P. Grey, Richard H. Friend, Samuel D. Stranks
Publicado en: ACS Energy Letters, Edición 5/6, 2020, Página(s) 1900-1907, ISSN 2380-8195
Editor: American Chemical Society
DOI: 10.1021/acsenergylett.0c00935

Solvent-dependent iodide interactions in LiO₂ electrolytes – a molecular dynamics study

Autores: Erlendur Jónsson; Astrid H. Berge; Clare P. Grey; Israel Temprano
Publicado en: Crossref, Edición 2, 2024, ISSN 1359-6640
Editor: Royal Society of Chemistry
DOI: 10.1039/d3fd00090g

Designing for conjugate addition: an amine functionalised quinone anolyte for redox flow batteries

Autores: Jethwa, RB (Jethwa, Rajesh B.); Zhao, EW (Zhao, Evan Wenbo); Kerber, RN (Kerber, Rachel N.); Jonsson, E (Jonsson, Erlendur); Wright, DS (Wright, Dominic S.); Grey, CP (Grey, Clare P.)
Publicado en: Journal of Materials Chemistry A, 2021, ISSN 2050-7488
Editor: Royal Society of Chemistry
DOI: 10.1039/d1ta02870g

Surface reduction in lithium- and manganese-rich layered cathodes for lithium ion batteries drives voltage decay

Autores: B. Wen, F.N. Sayed, W.M. Dose, J.K. Morzy, Y. Son, S. Nagendran, C. Ducati, C.P. Grey, M.F.L. De Volder
Publicado en: Journal of Materials Chemistry A, 2022, ISSN 2050-7488
Editor: Royal Society of Chemistry
DOI: 10.1039/d2ta04876k

Enhanced visible light absorption in layered Cs3Bi2Br9 through mixed-valence Sn(ii)/Sn(iv) doping.

Autores: Chantalle J Krajewska; Seán R. Kavanagh; Seán R. Kavanagh; Lina Zhang; Dominik J. Kubicki; Krishanu Dey; Krzysztof Galkowski; Krzysztof Galkowski; Krzysztof Galkowski; Clare P. Grey; Samuel D. Stranks; Aron Walsh; Aron Walsh; David O. Scanlon; Robert G. Palgrave
Publicado en: Chemical Science, Edición 3, 2021, ISSN 2041-6520
Editor: Royal Society of Chemistry
DOI: 10.1039/d1sc03775g

Potentiometric MRI of a Superconcentrated Lithium Electrolyte: Testing the Irreversible Thermodynamics Approach.

Autores: Andrew Wang; Anna B. Gunnarsdóttir; Jack Fawdon; Mauro Pasta; Clare P. Grey; Charles W. Monroe
Publicado en: ACS Energy Letters, Edición 1, 2021, ISSN 2380-8195
Editor: American Chemical Society
DOI: 10.17863/cam.77359

Mesoscopic simulations of the in situ NMR spectra of porous carbon based supercapacitors: electronic structure and adsorbent reorganisation effects.

Autores: Anagha Sasikumar; Anouar Belhboub; Camille Bacon; Alexander C. Forse; John M. Griffin; Clare P. Grey; Patrice Simon; Céline Merlet
Publicado en: Phys Chem Chem Phys, Edición 2, 2021, ISSN 1463-9076
Editor: Royal Society of Chemistry
DOI: 10.1039/d1cp02130c

Non-peer reviewed articles (1)

Triarylamines as Catholytes in Aqueous Organic Redox Flow Batteries

Autores: Nadia L. Farag; Rajesh B. Jethwa; Alice E. Beardmore; Teresa Insinna; Christopher A. O'Keefe; Peter A. A. Klusener; Clare P. Grey; Dominic S. Wright
Publicado en: Crossref, Edición 2, 2023, ISSN 1864-5631
Editor: Wiley - V C H Verlag GmbbH & Co.
DOI: 10.1002/cssc.202300128