39 citations · 60 across the 2 of their papers we have counts for
2 papers
physics.comp-ph2021★ 21 cited
Visualising energy landscapes through manifold learning
Benjamin W. B. Shires, Chris J. Pickard
Energy landscapes provide a conceptual framework for structure prediction, and a detailed understanding of their topological features is necessary to develop efficient methods for…
physics.chem-ph2021★ 39 cited
Ab initio random structure searching for battery cathode materials
Ziheng Lu, Bonan Zhu, Benjamin W. B. Shires +2
Cathodes are critical components of rechargeable batteries. Conventionally, the search for cathode materials relies on experimental trial-and-error and a traversing of existing com…