Takip et
Samuel William Coles
Samuel William Coles
Research Associate, Yusuf Hamied Department Of Chemistry, University Of Cambridge
cam.ac.uk üzerinde doğrulanmış e-posta adresine sahip
Başlık
Alıntı yapanlar
Alıntı yapanlar
Yıl
Correlation Length in Concentrated Electrolytes: Insights from All-Atom Molecular Dynamics Simulations
SW Coles, C Park, R Nikam, M Kanduc, J Dzubiella, B Rotenberg
The Journal of Physical Chemistry B 124 (9), 1778-1786, 2020
742020
Transition metal migration and O2 formation underpin voltage hysteresis in oxygen-redox disordered rocksalt cathodes
K McColl, RA House, GJ Rees, AG Squires, SW Coles, PG Bruce, ...
Nature Communications 13 (1), 1-8, 2022
732022
Interfacial structure and structural forces in mixtures of ionic liquid with a polar solvent
SW Coles, AM Smith, MV Fedorov, F Hausen, S Perkin
Faraday discussions 206, 427-442, 2018
542018
The nanostructure of a lithium glyme solvate ionic liquid at electrified interfaces
SW Coles, M Mishin, S Perkin, MV Fedorov, VB Ivaništšev
Physical Chemistry Chemical Physics 19 (18), 11004-11010, 2017
382017
A graphene surface force balance
J Britton, NEA Cousens, SW Coles, CD van Engers, V Babenko, ...
Langmuir 30 (38), 11485-11492, 2014
342014
Pushing the boundaries of lithium battery research with atomistic modelling on different scales
LM Morgan, MP Mercer, A Bhandari, C Peng, MM Islam, H Yang, ...
Progress in Energy 4 (1), 012002, 2021
292021
Phase segregation and nanoconfined fluid O2 in a lithium-rich oxide cathode
K McColl, SW Coles, P Zarabadi-Poor, BJ Morgan, MS Islam
Nature Materials 23 (6), 826-833, 2024
272024
Computing three-dimensional densities from force densities improves statistical efficiency
SW Coles, D Borgis, R Vuilleumier, B Rotenberg
The Journal of Chemical Physics 151 (6), 064124, 2019
242019
Simulation of a Solvate Ionic Liquid at a Polarizable Electrode with a Constant Potential
SW Coles, VB Ivaništšev
The Journal of Physical Chemistry C 123 (7), 3935-3943, 2019
202019
Electrochemistry: general discussion
A Abbott, L Aldous, N Borisenko, S Coles, O Fontaine, JDG Garcia, ...
Faraday discussions 206, 405-426, 2018
192018
Reduced variance analysis of molecular dynamics simulations by linear combination of estimators
SW Coles, E Mangaud, D Frenkel, B Rotenberg
The Journal of Chemical Physics 154 (19), 191101, 2021
162021
Dynamic Lone Pairs and Fluoride-Ion Disorder in Cubic-BaSnF4
B Mercadier, SW Coles, M Duttine, C Legein, M Body, OJ Borkiewicz, ...
Journal of the American Chemical Society 145 (43), 23739-23754, 2023
112023
Overscreening and underscreening in solid-electrolyte grain boundary space-charge layers
JM Dean, SW Coles, WR Saunders, AR McCluskey, MJ Wolf, AB Walker, ...
Physical Review Letters 127 (13), 135502, 2021
112021
Accurate estimation of diffusion coefficients and their uncertainties from computer simulation
AR McCluskey, SW Coles, BJ Morgan
Journal of Chemical Theory and Computation 21 (1), 79-87, 2024
92024
Anion-polarisation-directed short-range-order in antiperovskite Li 2 FeSO
SW Coles, V Falkowski, HS Geddes, GE Pérez, SG Booth, AG Squires, ...
Journal of Materials Chemistry A 11 (24), 13016-13026, 2023
92023
kinisi: Bayesian analysis of mass transport from molecular dynamics simulations
AR McCluskey, AG Squires, J Dunn, SW Coles, BJ Morgan
Journal of Open Source Software 9 (94), 1-3, 2024
72024
RevelsMD: Reduced Variance Estimators of the Local Structure in Molecular Dynamics
SW Coles, BJ Morgan, B Rotenberg
arXiv preprint arXiv:2310.06149, 2023
62023
Ionic liquids at interfaces: general discussion
A Abbott, M Addicoat, L Aldous, RG Bhuin, N Borisenko, JNC Lopes, ...
Faraday Discussions 206, 549-586, 2018
52018
Interfacial nanostructure of solvate ionic liquids and ionic liquid solutions
SW Coles
PQDT-UK & Ireland, 2018
12018
Nuclear quantum effects induce superionic proton transport in nanoconfined water
P Ravindra, XR Advincula, BX Shi, SW Coles, A Michaelides, V Kapil
arXiv preprint arXiv:2410.03272, 2024
2024
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