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Items: 1 to 50 of 195

1.

Ionic and Electronic Conduction in TiNb2O7.

Griffith KJ, Seymour ID, Hope MA, Butala MM, Lamontagne LK, Preefer MB, Koçer CP, Henkelman G, Morris AJ, Cliffe MJ, Dutton SE, Grey CP.

J Am Chem Soc. 2019 Sep 5. doi: 10.1021/jacs.9b06669. [Epub ahead of print]

PMID:
31487157
2.

Electrochemical Performance of Nanosized Disordered LiVOPO4.

Shi Y, Zhou H, Seymour ID, Britto S, Rana J, Wangoh LW, Huang Y, Yin Q, Reeves PJ, Zuba M, Chung Y, Omenya F, Chernova NA, Zhou G, Piper LFJ, Grey CP, Whittingham MS.

ACS Omega. 2018 Jul 3;3(7):7310-7323. doi: 10.1021/acsomega.8b00763. eCollection 2018 Jul 31.

3.

Cation Disorder and Lithium Insertion Mechanism of Wadsley-Roth Crystallographic Shear Phases from First Principles.

Koçer CP, Griffith KJ, Grey CP, Morris AJ.

J Am Chem Soc. 2019 Sep 12. doi: 10.1021/jacs.9b06316. [Epub ahead of print]

PMID:
31448601
4.

Short-range ordering in a battery electrode, the 'cation-disordered' rocksalt Li1.25Nb0.25Mn0.5O2.

Jones MA, Reeves PJ, Seymour ID, Cliffe MJ, Dutton SE, Grey CP.

Chem Commun (Camb). 2019 Aug 7;55(61):9027-9030. doi: 10.1039/c9cc04250d. Epub 2019 Jul 10.

PMID:
31290883
5.

When Do Anisotropic Magnetic Susceptibilities Lead to Large NMR Shifts? Exploring Particle Shape Effects in the Battery Electrode Material LiFePO4.

Pigliapochi R, O'Brien L, Pell AJ, Gaultois MW, Janssen Y, Khalifah PG, Grey CP.

J Am Chem Soc. 2019 Aug 21;141(33):13089-13100. doi: 10.1021/jacs.9b04674. Epub 2019 Aug 7.

PMID:
31271033
6.

A 17O paramagnetic NMR study of Sm2O3, Eu2O3, and Sm/Eu-substituted CeO2.

Hope MA, Halat DM, Lee J, Grey CP.

Solid State Nucl Magn Reson. 2019 Oct;102:21-30. doi: 10.1016/j.ssnmr.2019.05.010. Epub 2019 May 30.

PMID:
31226536
7.

Paramagnetic NMR in solution and the solid state.

Pell AJ, Pintacuda G, Grey CP.

Prog Nucl Magn Reson Spectrosc. 2019 Apr;111:1-271. doi: 10.1016/j.pnmrs.2018.05.001. Epub 2018 May 24. Review.

8.

Unraveling the Reaction Mechanisms of SiO Anodes for Li-Ion Batteries by Combining in Situ 7Li and ex Situ 7Li/29Si Solid-State NMR Spectroscopy.

Kitada K, Pecher O, Magusin PCMM, Groh MF, Weatherup RS, Grey CP.

J Am Chem Soc. 2019 May 1;141(17):7014-7027. doi: 10.1021/jacs.9b01589. Epub 2019 Apr 23.

PMID:
30964666
9.

Layered CeSO and LiCeSO Oxide Chalcogenides Obtained via Topotactic Oxidative and Reductive Transformations.

Cassidy SJ, Pitcher MJ, Lim JJK, Hadermann J, Allen JP, Watson GW, Britto S, Chong EJ, Free DG, Grey CP, Clarke SJ.

Inorg Chem. 2019 Mar 18;58(6):3838-3850. doi: 10.1021/acs.inorgchem.8b03485. Epub 2019 Feb 25.

PMID:
30799613
10.

Strongly coloured thiocyanate frameworks with perovskite-analogue structures.

Cliffe MJ, Keyzer EN, Dunstan MT, Ahmad S, De Volder MFL, Deschler F, Morris AJ, Grey CP.

Chem Sci. 2018 Oct 26;10(3):793-801. doi: 10.1039/c8sc04082f. eCollection 2019 Jan 21.

11.

Three-dimensional pulsed field gradient NMR measurements of self-diffusion in anisotropic materials for energy storage applications.

Engelke S, Marbella LE, Trease NM, De Volder M, Grey CP.

Phys Chem Chem Phys. 2019 Feb 20;21(8):4538-4546. doi: 10.1039/c8cp07776b.

PMID:
30735217
12.

Fluorine-free water-in-ionomer electrolytes for sustainable lithium-ion batteries.

He X, Yan B, Zhang X, Liu Z, Bresser D, Wang J, Wang R, Cao X, Su Y, Jia H, Grey CP, Frielinghaus H, Truhlar DG, Winter M, Li J, Paillard E.

Nat Commun. 2018 Dec 14;9(1):5320. doi: 10.1038/s41467-018-07331-6.

13.

The Role of Ionic Liquid Breakdown in the Electrochemical Metallization of VO2: An NMR Study of Gating Mechanisms and VO2 Reduction.

Hope MA, Griffith KJ, Cui B, Gao F, Dutton SE, Parkin SSP, Grey CP.

J Am Chem Soc. 2018 Dec 5;140(48):16685-16696. doi: 10.1021/jacs.8b09513. Epub 2018 Nov 21.

PMID:
30398339
14.

Correction: Synthesis of Ca(PF6)2, formed via nitrosonium oxidation of calcium.

Keyzer EN, Matthews PD, Liu Z, Bond AD, Grey CP, Wright DS.

Chem Commun (Camb). 2018 Nov 7;54(86):12271. doi: 10.1039/c8cc90442a. Epub 2018 Oct 16.

PMID:
30325367
15.

Niobium tungsten oxides for high-rate lithium-ion energy storage.

Griffith KJ, Wiaderek KM, Cibin G, Marbella LE, Grey CP.

Nature. 2018 Jul;559(7715):556-563. doi: 10.1038/s41586-018-0347-0. Epub 2018 Jul 25.

PMID:
30046074
16.

Identifying the Structural Evolution of the Sodium Ion Battery Na2 FePO4 F Cathode.

Li Q, Liu Z, Zheng F, Liu R, Lee J, Xu GL, Zhong G, Hou X, Fu R, Chen Z, Amine K, Mi J, Wu S, Grey CP, Yang Y.

Angew Chem Int Ed Engl. 2018 Sep 10;57(37):11918-11923. doi: 10.1002/anie.201805555. Epub 2018 Aug 19.

PMID:
30040187
17.

Understanding Fluoroethylene Carbonate and Vinylene Carbonate Based Electrolytes for Si Anodes in Lithium Ion Batteries with NMR Spectroscopy.

Jin Y, Kneusels NH, Marbella LE, Castillo-Martínez E, Magusin PCMM, Weatherup RS, Jónsson E, Liu T, Paul S, Grey CP.

J Am Chem Soc. 2018 Aug 8;140(31):9854-9867. doi: 10.1021/jacs.8b03408. Epub 2018 Jul 30.

PMID:
29979869
18.

Enabling multi-electron reaction of ε-VOPO4 to reach theoretical capacity for lithium-ion batteries.

Siu C, Seymour ID, Britto S, Zhang H, Rana J, Feng J, Omenya FO, Zhou H, Chernova NA, Zhou G, Grey CP, Piper LFJ, Whittingham MS.

Chem Commun (Camb). 2018 Jul 10;54(56):7802-7805. doi: 10.1039/c8cc02386g.

PMID:
29946607
19.

Mixed X-Site Formate-Hypophosphite Hybrid Perovskites.

Wu Y, Halat DM, Wei F, Binford T, Seymour ID, Gaultois MW, Shaker S, Wang J, Grey CP, Cheetham AK.

Chemistry. 2018 Aug 6;24(44):11309-11313. doi: 10.1002/chem.201803061. Epub 2018 Jul 13.

PMID:
29920832
20.

Sodiation and Desodiation via Helical Phosphorus Intermediates in High-Capacity Anodes for Sodium-Ion Batteries.

Marbella LE, Evans ML, Groh MF, Nelson J, Griffith KJ, Morris AJ, Grey CP.

J Am Chem Soc. 2018 Jun 27;140(25):7994-8004. doi: 10.1021/jacs.8b04183. Epub 2018 Jun 19.

21.

Towards an atomistic understanding of disordered carbon electrode materials.

Deringer VL, Merlet C, Hu Y, Lee TH, Kattirtzi JA, Pecher O, Csányi G, Elliott SR, Grey CP.

Chem Commun (Camb). 2018 Jun 8;54(47):5988-5991. doi: 10.1039/c8cc01388h.

22.

Realistic Atomistic Structure of Amorphous Silicon from Machine-Learning-Driven Molecular Dynamics.

Deringer VL, Bernstein N, Bartók AP, Cliffe MJ, Kerber RN, Marbella LE, Grey CP, Elliott SR, Csányi G.

J Phys Chem Lett. 2018 Jun 7;9(11):2879-2885. doi: 10.1021/acs.jpclett.8b00902. Epub 2018 May 17.

23.

Foreword: Special issue in honor of Alexander J. (Lex) Vega.

Grey CP, Polenova T, Vega S.

Solid State Nucl Magn Reson. 2018 Aug;92:12-13. doi: 10.1016/j.ssnmr.2018.03.004. Epub 2018 Apr 1. No abstract available.

PMID:
29653371
24.

Three-dimensional localization of nanoscale battery reactions using soft X-ray tomography.

Yu YS, Farmand M, Kim C, Liu Y, Grey CP, Strobridge FC, Tyliszczak T, Celestre R, Denes P, Joseph J, Krishnan H, Maia FRNC, Kilcoyne ALD, Marchesini S, Leite TPC, Warwick T, Padmore H, Cabana J, Shapiro DA.

Nat Commun. 2018 Mar 2;9(1):921. doi: 10.1038/s41467-018-03401-x.

25.

Proton distribution in Sc-doped BaZrO3: a solid state NMR and first principle calculations analysis.

Buannic L, Sperrin L, Dervişoğlu R, Blanc F, Grey CP.

Phys Chem Chem Phys. 2018 Feb 7;20(6):4317-4328. doi: 10.1039/c7cp08523k.

PMID:
29367980
26.

The Effect of Water on Quinone Redox Mediators in Nonaqueous Li-O2 Batteries.

Liu T, Frith JT, Kim G, Kerber RN, Dubouis N, Shao Y, Liu Z, Magusin PCMM, Casford MTL, Garcia-Araez N, Grey CP.

J Am Chem Soc. 2018 Jan 31;140(4):1428-1437. doi: 10.1021/jacs.7b11007. Epub 2018 Jan 18.

PMID:
29345915
27.

Stochasticity of Pores Interconnectivity in Li-O2 Batteries and its Impact on the Variations in Electrochemical Performance.

Torayev A, Rucci A, Magusin PCMM, Demortière A, De Andrade V, Grey CP, Merlet C, Franco AA.

J Phys Chem Lett. 2018 Feb 15;9(4):791-797. doi: 10.1021/acs.jpclett.7b03315. Epub 2018 Feb 3.

PMID:
29341616
28.

Localized concentration reversal of lithium during intercalation into nanoparticles.

Zhang W, Yu HC, Wu L, Liu H, Abdellahi A, Qiu B, Bai J, Orvananos B, Strobridge FC, Zhou X, Liu Z, Ceder G, Zhu Y, Thornton K, Grey CP, Wang F.

Sci Adv. 2018 Jan 12;4(1):eaao2608. doi: 10.1126/sciadv.aao2608. eCollection 2018 Jan.

29.

How Strong Is the Hydrogen Bond in Hybrid Perovskites?

Svane KL, Forse AC, Grey CP, Kieslich G, Cheetham AK, Walsh A, Butler KT.

J Phys Chem Lett. 2017 Dec 21;8(24):6154-6159. doi: 10.1021/acs.jpclett.7b03106. Epub 2017 Dec 11.

30.

Thermally reversible nanoparticle gels with tuneable porosity showing structural colour.

Ruff Z, Cloetens P, O'Neill T, Grey CP, Eiser E.

Phys Chem Chem Phys. 2017 Dec 20;20(1):467-477. doi: 10.1039/c7cp04835a.

PMID:
29214256
31.

Large-Scale Computation of Nuclear Magnetic Resonance Shifts for Paramagnetic Solids Using CP2K.

Mondal A, Gaultois MW, Pell AJ, Iannuzzi M, Grey CP, Hutter J, Kaupp M.

J Chem Theory Comput. 2018 Jan 9;14(1):377-394. doi: 10.1021/acs.jctc.7b00991. Epub 2017 Dec 13.

PMID:
29182320
32.

Nanoscale Detection of Intermediate Solid Solutions in Equilibrated LixFePO4 Microcrystals.

May BM, Yu YS, Holt MV, Strobridge FC, Boesenberg U, Grey CP, Cabana J.

Nano Lett. 2017 Dec 13;17(12):7364-7371. doi: 10.1021/acs.nanolett.7b03086. Epub 2017 Nov 30.

PMID:
29166027
33.

Selective observation of charge storing ions in supercapacitor electrode materials.

Forse AC, Griffin JM, Grey CP.

Solid State Nucl Magn Reson. 2018 Feb;89:45-49. doi: 10.1016/j.ssnmr.2017.10.003. Epub 2017 Nov 4.

34.

Understanding LiOH Chemistry in a Ruthenium-Catalyzed Li-O2 Battery.

Liu T, Liu Z, Kim G, Frith JT, Garcia-Araez N, Grey CP.

Angew Chem Int Ed Engl. 2017 Dec 11;56(50):16057-16062. doi: 10.1002/anie.201709886. Epub 2017 Nov 21.

35.

Identifying the Structural Basis for the Increased Stability of the Solid Electrolyte Interphase Formed on Silicon with the Additive Fluoroethylene Carbonate.

Jin Y, Kneusels NH, Magusin PCMM, Kim G, Castillo-Martínez E, Marbella LE, Kerber RN, Howe DJ, Paul S, Liu T, Grey CP.

J Am Chem Soc. 2017 Oct 25;139(42):14992-15004. doi: 10.1021/jacs.7b06834. Epub 2017 Oct 13.

PMID:
28933161
36.

Distinguishing faceted oxide nanocrystals with 17O solid-state NMR spectroscopy.

Li Y, Wu XP, Jiang N, Lin M, Shen L, Sun H, Wang Y, Wang M, Ke X, Yu Z, Gao F, Dong L, Guo X, Hou W, Ding W, Gong XQ, Grey CP, Peng L.

Nat Commun. 2017 Sep 18;8(1):581. doi: 10.1038/s41467-017-00603-7.

37.

Lithiation Thermodynamics and Kinetics of the TiO2 (B) Nanoparticles.

Hua X, Liu Z, Fischer MG, Borkiewicz O, Chupas PJ, Chapman KW, Steiner U, Bruce PG, Grey CP.

J Am Chem Soc. 2017 Sep 27;139(38):13330-13341. doi: 10.1021/jacs.7b05228. Epub 2017 Sep 12.

38.

In Situ Neutron Diffraction Studies of the Ion Exchange Synthesis Mechanism of Li2Mg2P3O9N: Evidence for a Hidden Phase Transition.

Liu J, Whitfield PS, Saccomanno MR, Bo SH, Hu E, Yu X, Bai J, Grey CP, Yang XQ, Khalifah PG.

J Am Chem Soc. 2017 Jul 12;139(27):9192-9202. doi: 10.1021/jacs.7b02323. Epub 2017 Jun 27.

PMID:
28586223
39.

Low-power broadband solid-state MAS NMR of 14N.

Pell AJ, Sanders KJ, Wegner S, Pintacuda G, Grey CP.

J Chem Phys. 2017 May 21;146(19):194202. doi: 10.1063/1.4983220.

40.

Donor-acceptor stacking arrangements in bulk and thin-film high-mobility conjugated polymers characterized using molecular modelling and MAS and surface-enhanced solid-state NMR spectroscopy.

Chaudhari SR, Griffin JM, Broch K, Lesage A, Lemaur V, Dudenko D, Olivier Y, Sirringhaus H, Emsley L, Grey CP.

Chem Sci. 2017 Apr 1;8(4):3126-3136. doi: 10.1039/c7sc00053g. Epub 2017 Feb 14.

41.

Investigating Sodium Storage Mechanisms in Tin Anodes: A Combined Pair Distribution Function Analysis, Density Functional Theory, and Solid-State NMR Approach.

Stratford JM, Mayo M, Allan PK, Pecher O, Borkiewicz OJ, Wiaderek KM, Chapman KW, Pickard CJ, Morris AJ, Grey CP.

J Am Chem Soc. 2017 May 31;139(21):7273-7286. doi: 10.1021/jacs.7b01398. Epub 2017 May 16.

PMID:
28471174
42.

Synthesis of Ca(PF6)2, formed via nitrosonium oxidation of calcium.

Keyzer EN, Matthews PD, Liu Z, Bond AD, Grey CP, Wright DS.

Chem Commun (Camb). 2017 Apr 20;53(33):4573-4576. doi: 10.1039/c7cc01938f. Erratum in: Chem Commun (Camb). 2018 Nov 7;54(86):12271.

PMID:
28387415
43.

Metal-Organic Nanosheets Formed via Defect-Mediated Transformation of a Hafnium Metal-Organic Framework.

Cliffe MJ, Castillo-Martínez E, Wu Y, Lee J, Forse AC, Firth FCN, Moghadam PZ, Fairen-Jimenez D, Gaultois MW, Hill JA, Magdysyuk OV, Slater B, Goodwin AL, Grey CP.

J Am Chem Soc. 2017 Apr 19;139(15):5397-5404. doi: 10.1021/jacs.7b00106. Epub 2017 Apr 5.

44.

Structural Stability from Crystallographic Shear in TiO2-Nb2O5 Phases: Cation Ordering and Lithiation Behavior of TiNb24O62.

Griffith KJ, Senyshyn A, Grey CP.

Inorg Chem. 2017 Apr 3;56(7):4002-4010. doi: 10.1021/acs.inorgchem.6b03154. Epub 2017 Mar 20.

PMID:
28319367
45.

Exploring Oxygen Activity in the High Energy P2-Type Na0.78Ni0.23Mn0.69O2 Cathode Material for Na-Ion Batteries.

Ma C, Alvarado J, Xu J, Clément RJ, Kodur M, Tong W, Grey CP, Meng YS.

J Am Chem Soc. 2017 Apr 5;139(13):4835-4845. doi: 10.1021/jacs.7b00164. Epub 2017 Mar 22.

PMID:
28271898
46.

Surface-Sensitive NMR Detection of the Solid Electrolyte Interphase Layer on Reduced Graphene Oxide.

Leskes M, Kim G, Liu T, Michan AL, Aussenac F, Dorffer P, Paul S, Grey CP.

J Phys Chem Lett. 2017 Mar 2;8(5):1078-1085. doi: 10.1021/acs.jpclett.6b02590. Epub 2017 Feb 21.

PMID:
28195488
47.

Structural Evolution and Atom Clustering in β-SiAlON: β-Si6-zAlzOzN8-z.

Cozzan C, Griffith KJ, Laurita G, Hu JG, Grey CP, Seshadri R.

Inorg Chem. 2017 Feb 20;56(4):2153-2158. doi: 10.1021/acs.inorgchem.6b02780. Epub 2017 Feb 6.

48.

Surface-selective direct 17O DNP NMR of CeO2 nanoparticles.

Hope MA, Halat DM, Magusin PC, Paul S, Peng L, Grey CP.

Chem Commun (Camb). 2017 Feb 9;53(13):2142-2145. doi: 10.1039/c6cc10145c.

PMID:
28134945
49.

Enhanced efficiency of solid-state NMR investigations of energy materials using an external automatic tuning/matching (eATM) robot.

Pecher O, Halat DM, Lee J, Liu Z, Griffith KJ, Braun M, Grey CP.

J Magn Reson. 2017 Feb;275:127-136. doi: 10.1016/j.jmr.2016.12.008. Epub 2016 Dec 23.

50.

Sustainability and in situ monitoring in battery development.

Grey CP, Tarascon JM.

Nat Mater. 2016 Dec 20;16(1):45-56. doi: 10.1038/nmat4777. Review.

PMID:
27994251

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