activity
20232026
most citedScalable Crystal Structure Relaxation Using an Iteration-Free Deep Generative Model with Uncertainty Quantification

1 citations · 1 across the 4 of their papers we have counts for

collaborators
Showing cs.CEShow all

1 paper · 1 filter

cs.CE2023

Lightweight equivariant model for efficient machine learning interatomic potentials

Ziduo Yang, Xian Wang, Yifan Li +3

In modern computational materials science, deep learning has shown the capability to predict interatomic potentials, thereby supporting and accelerating conventional simulations. H…