| Dynamics of a molecular glass former: Energy landscapes for diffusion in ortho-terphenyl SP Niblett, VK de Souza, JD Stevenson, DJ Wales The Journal of chemical physics 145 (2), 024505, 2016 | 38 | 2016 |
| Learning intermolecular forces at liquid–vapor interfaces SP Niblett, M Galib, DT Limmer The Journal of Chemical Physics 155 (16), 164101, 2021 | 36 | 2021 |
| Optimal Alignment of Structures for Finite and Periodic Systems M Griffiths, SP Niblett, DJ Wales Journal of chemical theory and computation 13 (10), 4914-4931, 2017 | 31 | 2017 |
| Defining and quantifying frustration in the energy landscape: Applications to atomic and molecular clusters, biomolecules, jammed and glassy systems VK de Souza, JD Stevenson, SP Niblett, JD Farrell, DJ Wales The Journal of chemical physics 146 (12), 124103, 2017 | 31 | 2017 |
| Pathways for diffusion in the potential energy landscape of the network glass former SiO2 SP Niblett, M Biedermann, DJ Wales, VK de Souza The Journal of chemical physics 147 (15), 152726, 2017 | 25 | 2017 |
| Dynamics and thermodynamics of the coronene octamer described by coarse-grained potentials J Hernández-Rojas, F Calvo, S Niblett, DJ Wales Physical Chemistry Chemical Physics 19 (3), 1884-1895, 2017 | 21 | 2017 |
| A foundation model for atomistic materials chemistry I Batatia, P Benner, Y Chiang, AM Elena, DP Kovács, J Riebesell, ... arXiv preprint arXiv:2401.00096, 2023 | 16 | 2023 |
| Effects of random pinning on the potential energy landscape of a supercooled liquid SP Niblett, VK de Souza, RL Jack, DJ Wales The Journal of chemical physics 149 (11), 114503, 2018 | 16 | 2018 |
| Crystal Structure Prediction for Benzene Using Basin-Hopping Global Optimization A Banerjee, D Jasrasaria, SP Niblett, DJ Wales The Journal of Physical Chemistry A 125 (17), 3776-3784, 2021 | 15 | 2021 |
| Ion Dissociation Dynamics in an Aqueous Premelting Layer SP Niblett, DT Limmer The Journal of Physical Chemistry B 125 (8), 2174-2181, 2021 | 14 | 2021 |
| Scientific Machine Learning of 2D Perovskite Nanosheet Formation JC Dahl, S Niblett, Y Cho, X Wang, Y Zhang, EM Chan, AP Alivisatos Journal of the American Chemical Society 145 (42), 23076-23087, 2023 | 3 | 2023 |
| Understanding Sorption of Aqueous Electrolytes in Porous Carbon by NMR spectroscopy D Lyu, K Märker, Y Zhou, EW Zhao, A Gunnarsdóttir, S Niblett, A Forse, ... | 1 | 2024 |
| Effect of Ionic Association in the Catalytic Mechanism of Redox Mediators for Li-air Batteries: a Theoretical Framework G Horwitz, V Kunz, S Niblett, C Grey | | 2023 |
| Ion Pair Dissociation Dynamics in an Aqueous Premelting Layer SP Niblett, DT Limmer arXiv preprint arXiv:2012.09881, 2020 | | 2020 |
| Higher Order Structure in the Energy Landscapes of Model Glass Formers SP Niblett University of Cambridge, 2018 | | 2018 |
| Research Data supporting" Pathways for diffusion in the potential energy landscape of the network glass former SiO2", J. Chem. Phys. 147 (2017) S Niblett, M Biedermann, D Wales, V de Souza | | 2017 |
| Research data supporting [Defining and Quantifying frustration in the energy landscape: Applications to atomic and molecular clusters, biomolecules, jammed and glassy systems]. SVK De, DJ Wales, JD Stevenson, S Niblett, JD Farrell, CP Goodrich | | 2017 |
