| The ONETEP linear-scaling density functional theory program JCA Prentice, J Aarons, JC Womack, AEA Allen, L Andrinopoulos, ... The Journal of chemical physics 152 (17), 2020 | 159 | 2020 |
| Reconciling work functions and adsorption enthalpies for implicit solvent models: a Pt (111)/water interface case study G Bramley, MT Nguyen, VA Glezakou, R Rousseau, CK Skylaris Journal of chemical theory and computation 16 (4), 2703-2715, 2020 | 42 | 2020 |
| The application of QM/MM simulations in heterogeneous catalysis GA Bramley, OT Beynon, PV Stishenko, AJ Logsdail Physical Chemistry Chemical Physics 25 (9), 6562-6585, 2023 | 22 | 2023 |
| Understanding adsorption of organics on Pt (111) in the aqueous phase: Insights from DFT based implicit solvent and statistical thermodynamics models GA Bramley, MT Nguyen, VA Glezakou, R Rousseau, CK Skylaris Journal of Chemical Theory and Computation 18 (3), 1849-1861, 2022 | 14 | 2022 |
| Anchoring highly dispersed metal nanoparticles by strong electrostatic adsorption (SEA) on a dealuminated beta zeolite for catalysis R Zou, GA Bramley, S Xu, S Chansai, M Panchal, H Chen, Y Zhou, P Gao, ... Catalysis Science & Technology 14 (1), 164-173, 2024 | 1 | 2024 |
| ONETEP solvent and electrolyte model J Dziedzic, JC Womack, A Bhandari, G Bramley | 1 | 2020 |
| Improvements in periodic representation of solvated systems with FHI-aims (1.0) PV Stishenko, J Filser, G Bramley, R Maurer, V Blum, H Oberhofer, ... Zenodo, 2024 | | 2024 |
| rsc. li/pccp GA Bramley, OT Beynon, PV Stishenko, AJ Logsdail, Y Ma, L Lin, ... Phys. Chem. Chem. Phys 25, 6602, 2023 | | 2023 |
| Developing and evaluating implicit solvent models for catalytic metallic surfaces G Bramley University of Southampton, 2022 | | 2022 |
| eCSE Technical Report for ARCHER2-eCSE08-3 Improvements in periodic representation of solvated systems with FHI-aims A Logsdail, G Bramley, PV Stishenko | | |
| Implicit Solvent and Multipole Corrections with Coulomb Cut-off G Bramley | | |
