2 citations · 4 across the 3 of their papers we have counts for
5 papers
Long-range electrostatics for machine learning interatomic potentials is easier than we thought
Dongjin Kim, Bingqing Cheng
The lack of long-range electrostatics is a key limitation of modern machine learning interatomic potentials (MLIPs), hindering reliable applications to interfaces, charge-transfer…
A universal augmentation framework for long-range electrostatics in machine learning interatomic potentials
Dongjin Kim, Xiaoyu Wang, Peichen Zhong +3
Most current machine learning interatomic potentials (MLIPs) rely on short-range approximations, without explicit treatment of long-range electrostatics. To address this, we recent…
Machine learning interatomic potential can infer electrical response
Peichen Zhong, Dongjin Kim, Daniel S. King +1
Modeling the response of material and chemical systems to electric fields remains a longstanding challenge. Machine learning interatomic potentials (MLIPs) offer an efficient and s…
Foundation Models for Atomistic Simulation of Chemistry and Materials
Eric C. -Y. Yuan, Yunsheng Liu, Junmin Chen +11
Given the power of large language and large vision models, it is of profound and fundamental interest to ask if a foundational model based on data and parameter scaling laws and pr…
Learning charges and long-range interactions from energies and forces
Dongjin Kim, Daniel S. King, Peichen Zhong +1
Accurate modeling of long-range forces is critical in atomistic simulations, as they play a central role in determining the properties of materials and chemical systems. However, s…