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  • Currently displaying 301 - 320 of 812 publications
Towards an atomistic understanding of disordered carbon electrode materials.
VL Deringer, C Merlet, Y Hu, TH Lee, JA Kattirtzi, O Pecher, G Csányi, SR Elliott, CP Grey
– Chemical Communications
(2018)
54,
5988
(doi: 10.1039/c8cc01388h)
Revealing Local Dynamics of the Protonic Conductor CsH(PO3H) by Solid-State NMR Spectroscopy and First-Principles Calculations
G Kim, JM Griffin, F Blanc, DM Halat, SM Haile, CP Grey
– The Journal of Physical Chemistry C
(2017)
121,
27830
(doi: 10.1021/acs.jpcc.7b09063)
Large-Scale Computation of Nuclear Magnetic Resonance Shifts for Paramagnetic Solids Using CP2K.
A Mondal, MW Gaultois, AJ Pell, M Iannuzzi, CP Grey, J Hutter, M Kaupp
– Journal of chemical theory and computation
(2017)
14,
377
(doi: 10.1021/acs.jctc.7b00991)
How Strong Is the Hydrogen Bond in Hybrid Perovskites?
KL Svane, AC Forse, CP Grey, G Kieslich, AK Cheetham, A Walsh, KT Butler
– Journal of Physical Chemistry Letters
(2017)
8,
6154
(doi: 10.1021/acs.jpclett.7b03106)
Nanostructured MOFs through defect engineering
M Cliffe, CP Grey
– Acta Crystallographica Section A Foundations and Advances
(2017)
73,
C354
(doi: 10.1107/s2053273317092191)
New developments in surface-enhanced solid-state NMR spectroscopy and their applications
SR Chaudhari, JM Griffin, M Lelli, K Broch, V Lemaur, Y Olivier, H Sirringhaus, CP Grey, A Lessage, L Emsley
– Acta Crystallographica Section A: Foundations and advances
(2017)
70,
c321
(doi: 10.1107/s205327331709252x)
Theoretical and experimental screening methods for functional materials design
M Dunstan, C Lau, C Kocer, W Hu, J Dennis, A Morris, S Scott, C Grey
– Acta Crystallographica Section A: Foundations and advances
(2017)
73,
c74
(doi: 10.1107/s2053273317094967)
Nanoscale Detection of Intermediate Solid Solutions in Equilibrated LixFePO4 Microcrystals
BM May, Y-S Yu, MV Holt, FC Strobridge, U Boesenberg, CP Grey, J Cabana
– Nano Letters
(2017)
17,
7364
(doi: 10.1021/acs.nanolett.7b03086)
Understanding LiOH Chemistry in a Ruthenium‐Catalyzed Li–O2 Battery
T Liu, Z Liu, G Kim, JT Frith, N Garcia‐Araez, CP Grey
– Angewandte Chemie
(2017)
129,
16273
(doi: 10.1002/ange.201709886)
Selective observation of charge storing ions in supercapacitor electrode materials.
AC Forse, JM Griffin, CP Grey
– Solid State Nuclear Magnetic Resonance
(2017)
89,
45
(doi: 10.1016/j.ssnmr.2017.10.003)
Understanding LiOH Chemistry in a Ruthenium-Catalyzed Li-O2 Battery.
T Liu, Z Liu, G Kim, JT Frith, N Garcia-Araez, CP Grey
– Angewandte Chemie (International ed. in English)
(2017)
56,
16057
(doi: 10.1002/anie.201709886)
Identifying the Structural Basis for the Increased Stability of the Solid Electrolyte Interphase Formed on Silicon with the Additive Fluoroethylene Carbonate
Y Jin, N-JH Kneusels, PCMM Magusin, G Kim, E Castillo-Martínez, LE Marbella, RN Kerber, DJ Howe, S Paul, T Liu, CP Grey
– Journal of the American Chemical Society
(2017)
139,
14992
(doi: 10.1021/jacs.7b06834)
Ion Dynamics and CO2 Absorption Properties of Nb-, Ta-, and Y-Doped Li2ZrO3 Studied by Solid-State NMR, Thermogravimetry, and First-Principles Calculations
MT Dunstan, H Laeverenz Schlogelhofer, JM Griffin, MS Dyer, MW Gaultois, CY Lau, SA Scott, CP Grey
– The Journal of Physical Chemistry C
(2017)
121,
21877
(doi: 10.1021/acs.jpcc.7b05888)
Distinguishing faceted oxide nanocrystals with 17O solid-state NMR spectroscopy.
Y Li, X-P Wu, N Jiang, M Lin, L Shen, H Sun, Y Wang, M Wang, X Ke, Z Yu, F Gao, L Dong, X Guo, W Hou, W Ding, X-Q Gong, CP Grey, L Peng
– Nature communications
(2017)
8,
581
(doi: 10.1038/s41467-017-00603-7)
SFG Study of the Potential-Dependent Adsorption of the p-Toluenesulfonate Anion at an Activated Carbon/Propylene Carbonate Interface
EK Humphreys, MTL casford, PK Allan, CP Grey, SM Clarke
– The Journal of Physical Chemistry C
(2017)
121,
20567
(doi: 10.1021/acs.jpcc.7b04731)
Lithiation Thermodynamics and Kinetics of the TiO2 (B) Nanoparticles
X Hua, Z Liu, MG Fischer, O Borkiewicz, PJ Chupas, KW Chapman, U Steiner, PG Bruce, CP Grey
– J Am Chem Soc
(2017)
139,
13330
(doi: 10.1021/jacs.7b05228)
Infrared-active optical phonons in LiFePO4 single crystals
TN Stanislavchuk, DS Middlemiss, JS Syzdek, Y Janssen, R Basistyy, AA Sirenko, PG Khalifah, CP Grey, R Kostecki
– Journal of Applied Physics
(2017)
122,
045107
(doi: 10.1063/1.4995282)
Structural Simplicity as a Restraint on the Structure of Amorphous Silicon
MJ Cliffe, AP Bartók, RN Kerber, CP Grey, G Csanyi, AL Goodwin
– Physical Review B - Condensed Matter and Materials Physics
(2017)
95,
224108
(doi: 10.1103/physrevb.95.224108)
In Situ Neutron Diffraction Studies of the Ion Exchange Synthesis Mechanism of Li2Mg2P3O9N: Evidence for a Hidden Phase Transition
J Liu, PS Whitfield, MR Saccomanno, S-H Bo, E Hu, X Yu, J Bai, CP Grey, X-Q Yang, PG Khalifah
– J Am Chem Soc
(2017)
139,
9192
(doi: 10.1021/jacs.7b02323)
Unraveling the Complex Delithiation and Lithiation Mechanisms of the High Capacity Cathode Material V6O13
W Meng, R Pigliapochi, PM Bayley, O Pecher, MW Gaultois, ID Seymour, HP Liang, W Xu, KM Wiaderek, KW Chapman, CP Grey
– Chemistry of Materials
(2017)
29,
5513
(doi: 10.1021/acs.chemmater.7b00428)

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