Elucidating the nature of grain boundary resistance in lithium lanthanum titanate AR Symington, M Molinari, JA Dawson, JM Statham, J Purton, P Canepa, ... Journal of Materials Chemistry A 9 (10), 6487-6498, 2021 | 57 | 2021 |
Computer-aided design of nanoceria structures as enzyme mimetic agents: The role of bodily electrolytes on maximizing their activity M Molinari, AR Symington, DC Sayle, TS Sakthivel, S Seal, SC Parker ACS Applied Bio Materials 2 (3), 1098-1106, 2019 | 36 | 2019 |
Strongly bound surface water affects the shape evolution of cerium oxide nanoparticles AR Symington, M Molinari, S Moxon, JM Flitcroft, DC Sayle, SC Parker The Journal of Physical Chemistry C 124 (6), 3577-3588, 2020 | 33 | 2020 |
The role of dopant segregation on the oxygen vacancy distribution and oxygen diffusion in CeO2 grain boundaries AR Symington, M Molinari, J Statham, J Wu, SC Parker Journal of Physics: Energy 1 (4), 042005, 2019 | 28 | 2019 |
Quantifying the impact of disorder on Li-ion and Na-ion transport in perovskite titanate solid electrolytes for solid-state batteries AR Symington, J Purton, J Statham, M Molinari, MS Islam, SC Parker Journal of Materials Chemistry A 8 (37), 19603-19611, 2020 | 23 | 2020 |
Thermodynamic evolution of cerium oxide nanoparticle morphology using carbon dioxide AR Symington, RM Harker, MT Storr, M Molinari, SC Parker The Journal of Physical Chemistry C 124 (42), 23210-23220, 2020 | 20 | 2020 |
Defect segregation facilitates oxygen transport at fluorite UO2 grain boundaries AR Symington, M Molinari, NA Brincat, NR Williams, SC Parker Philosophical Transactions of the Royal Society A 377 (2152), 20190026, 2019 | 17 | 2019 |
The energetics of carbonated PuO 2 surfaces affects nanoparticle morphology: a DFT+ U study S Moxon, AR Symington, ST Joshua, J Dawson, JM Flitcroft, SC Parker, ... Physical Chemistry Chemical Physics 22 (15), 7728-7737, 2020 | 14 | 2020 |
surfinpy: A surface phase diagram generator AR Symington, J Tse, M Molinari, A Marmier, SC Parker Journal of Open Source Software 4 (34), 1210, 2019 | 11 | 2019 |
An introduction to classical molecular dynamics simulation for experimental scattering users AR McCluskey, J Grant, AR Symington, T Snow, J Doutch, BJ Morgan, ... Journal of Applied Crystallography 52 (3), 665-668, 2019 | 7 | 2019 |
Impact of Hydrogen on the Intermediate Oxygen Clusters and Diffusion in Fluorite Structured UO2+x JM Flitcroft, AR Symington, M Molinari, NA Brincat, NR Williams, ... Inorganic Chemistry 58 (6), 3774-3779, 2019 | 3 | 2019 |
Composition-dependent morphologies of CeO 2 nanoparticles in the presence of Co-adsorbed H 2 O and CO 2: a density functional theory study S Moxon, AR Symington, ST Joshua, JM Flitcroft, JM Skelton, LJ Gillie, ... Nanoscale 16 (23), 11232-11249, 2024 | 2 | 2024 |
SurfinPy 2.0: A Phase Diagram Generator for Surfaces and Bulk Phases ST Joshua, M Molinari, SC Parker, AR Symington Journal of Open Source Software 7 (71), 4014, 2022 | 2 | 2022 |
polypy-Analysis Tools for Solid State Molecular Dynamics and Monte Carlo Trajectories AR Symington Journal of Open Source Software 6 (59), 2824, 2021 | 1 | 2021 |
Influence of carbon dioxide on the energetics of cerium oxide surfaces and nanoparticle morphology A Symington, RM Harker, MT Storr, M Molinari, SC Parker | 1 | 2020 |
symmy596/SurfinPy: SurfinPy 2.0: A Phase Diagram Generator for Surfaces and Bulk Phases J Tse, M Molinari, SC Parker, AR Symington | | 2022 |
Trivalent impurities promote oxygen vacancy segregation and increase oxygen transport at actinide oxide grain boundaries A Symington, J Grant, M Molinari, SC Parker Plutonium Futures: The Science 2018, 165-167, 2018 | | 2018 |
Computer-Aided Design of Nanoceria as an Enzyme Mimetic Agent: A Structural Prediction to Maximise its Activity M Molinari, AR Symington, DC Sayle, TS Sakthivel, S Seal, SC Parkerb | | |
polypy-Analysis Tools for Solid State Molecular AR Symington | | |
Altering the Properties of Fluorite Oxide Interfaces with Trivalent Impurity Cations A Symington, J Grant, M Molinari, SC Parker | | |