Rachel Nathaniel Kerber
Rachel Nathaniel Kerber
Senior Scientist, Johnson Matthey Technology Centre
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Fluoroethylene carbonate and vinylene carbonate reduction: Understanding lithium-ion battery electrolyte additives and solid electrolyte interphase formation
AL Michan, BS Parimalam, M Leskes, RN Kerber, T Yoon, CP Grey, ...
Chemistry of Materials 28 (22), 8149-8159, 2016
Realistic atomistic structure of amorphous silicon from machine-learning-driven molecular dynamics
VL Deringer, N Bernstein, AP Bartók, MJ Cliffe, RN Kerber, LE Marbella, ...
The journal of physical chemistry letters 9 (11), 2879-2885, 2018
Identifying the structural basis for the increased stability of the solid electrolyte interphase formed on silicon with the additive fluoroethylene carbonate
Y Jin, NJH Kneusels, PCMM Magusin, G Kim, E Castillo-Martínez, ...
Journal of the American Chemical Society 139 (42), 14992-15004, 2017
The Effect of Water on Quinone Redox Mediators in Nonaqueous Li-O2 Batteries
T Liu, JT Frith, G Kim, RN Kerber, N Dubouis, Y Shao, Z Liu, ...
Journal of the American Chemical Society 140 (4), 1428-1437, 2018
Nature and structure of aluminum surface sites grafted on silica from a combination of high-field aluminum-27 solid-state NMR spectroscopy and first-principles calculations
RN Kerber, A Kermagoret, E Callens, P Florian, D Massiot, A Lesage, ...
Journal of the American Chemical Society 134 (15), 6767-6775, 2012
Exfoliation of Layered Na-Ion Anode Material Na2Ti3O7 for Enhanced Capacity and Cyclability
MA Tsiamtsouri, PK Allan, AJ Pell, JM Stratford, G Kim, RN Kerber, ...
Chemistry of Materials 30 (5), 1505-1516, 2018
Understanding LiOH Formation in a Li-O2 Battery with LiI and H2O Additives
T Liu, G Kim, E Jonsson, E Castillo-Martinez, I Temprano, Y Shao, ...
ACS Catalysis 9 (1), 66-77, 2018
Chlorodiethylaluminum supported on silica: A dinuclear aluminum surface species with bridging μ2-Cl-ligand as a highly efficient co-catalyst for the Ni-catalyzed dimerization …
A Kermagoret, RN Kerber, MP Conley, E Callens, P Florian, D Massiot, ...
Journal of catalysis 313, 46-54, 2014
Triisobutylaluminum: bulkier and yet more reactive towards silica surfaces than triethyl or trimethylaluminum
A Kermagoret, RN Kerber, MP Conley, E Callens, P Florian, D Massiot, ...
Dalton Transactions 42 (35), 12681-12687, 2013
Structural simplicity as a restraint on the structure of amorphous silicon
MJ Cliffe, AP Bartók, RN Kerber, CP Grey, G Csányi, AL Goodwin
Physical Review B 95 (22), 224108, 2017
Density functional study of the interaction of 3‐(ω‐bromoacetyl) coumarin with phosphites
R Nathaniel, T Mineva, R Nikolova, A Bojilova
International journal of quantum chemistry 106 (6), 1357-1366, 2006
Two bonding configurations of acetylene on Si (001)-(2× 1): A combined high-resolution electron energy loss spectroscopy and density functional theory study
T Mineva, R Nathaniel, KL Kostov, W Widdra
The Journal of chemical physics 125 (19), 2006
Vibrational characterization of ethylene adsorption and its thermal evolution on Si (001)-(2× 1): Identification of majority and minority species
KL Kostov, R Nathaniel, T Mineva, W Widdra
The Journal of chemical physics 133 (5), 2010
Grafting trimethylaluminum and its halogen derivatives on silica: general trends for 27 Al SS-NMR response from first principles calculations
RN Kerber, T Kerber, X Rozanska, F Delbecq, P Sautet
Physical Chemistry Chemical Physics 17 (40), 26937-26945, 2015
Quantum computation for periodic solids in second quantization
AV Ivanov, C Sünderhauf, N Holzmann, T Ellaby, RN Kerber, G Jones, ...
Physical Review Research 5 (1), 013200, 2023
Designing for conjugate addition: an amine functionalised quinone anolyte for redox flow batteries
RB Jethwa, EW Zhao, RN Kerber, E Jónsson, DS Wright, CP Grey
Journal of Materials Chemistry A 9 (27), 15188-15198, 2021
Structural Simplicity as a Constraint on the Structure of Amorphous Silicon
MJ Cliffe, AP Bartok, RN Kerber, CP Grey, G Csanyi, AL Goodwin
arXiv preprint arXiv:1609.00668, 2016
Quantum Computation for Periodic Solids in Second Quantization
C Sünderhauf, A Ivanov, N Holzmann, T Ellaby, R Kerber, G Jones, ...
Bulletin of the American Physical Society, 2023
QMX: A versatile environment for hybrid calculations applied to the grafting of Al2Cl3Me3 on a silica surface
T Kerber, RN Kerber, X Rozanska, P Sautet, P Fleurat‐Lessard
Journal of Computational Chemistry 34 (13), 1155-1163, 2013
An Exploration of Nitrogen-Rich Fused Heteroaromatic Quinones for Redox Flow Battery Applications
R Jethwa, D Hey, R Kerber, DS Wright, CP Grey
Electrochemical Society Meeting Abstracts 241, 2013-2013, 2022
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