Preprint
Aug 2026
Universal Machine-learning Molecular Dynamics at the Speed of Empirical Potentials
DPA4C is introduced, an equivariant potential whose architecture and compressed CUDA operators are co-designed under deployment constraints to pursue accuracy and efficiency together and brings quantum-trained universal accuracy into a regime of speed and system size previously associated with empirical potentials.
Tian-Cheng Li, Jianming Xue, Linfeng Zhang et al.
· 3 citations