203 citations · 216 across the 18 of their papers we have counts for
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cond-mat.mtrl-sci2024★ 1 cited
Charge-constrained Atomic Cluster Expansion
Matteo Rinaldi, Anton Bochkarev, Yury Lysogorskiy +1
The atomic cluster expansion (ACE) efficiently parameterizes complex energy surfaces of pure elements and alloys. Due to the local nature of the many-body basis, ACE is inherently…
physics.comp-ph2024★ 4 cited
Adaptive-precision potentials for large-scale atomistic simulations
David Immel, Ralf Drautz, Godehard Sutmann
Large-scale atomistic simulations rely on interatomic potentials providing an efficient representation of atomic energies and forces. Modern machine-learning (ML) potentials provid…