activity
20222026
most citedOrb: A Fast, Scalable Neural Network Potential

49 citations · 61 across the 7 of their papers we have counts for

collaborators

7 papers

nucl-th2026

From decay to cluster decay: an extreme case of transfer learning

Yinu Zhang, Zhiyi Li, Kele Li +2

When training data are limited, data-driven models are especially vulnerable to optimization-related fluctuations from random initialization and to sampling-induced bias from insuf…

cs.CV2025

Generalized Dynamics Generation towards Scannable Physical World Model

Yichen Li, Zhiyi Li, Brandon Feng +2

Digital twin worlds with realistic interactive dynamics presents a new opportunity to develop generalist embodied agents in scannable environments with complex physical behaviors.…

cond-mat.mtrl-sci2024★ 49 cited

Orb: A Fast, Scalable Neural Network Potential

Mark Neumann, James Gin, Benjamin Rhodes +5

We introduce Orb, a family of universal interatomic potentials for atomistic modelling of materials. Orb models are 3-6 times faster than existing universal potentials, stable unde…

cs.CV2023

Obj-NeRF: Extract Object NeRFs from Multi-view Images

Zhiyi Li, Lihe Ding, Tianfan Xue

Neural Radiance Fields (NeRFs) have demonstrated remarkable effectiveness in novel view synthesis within 3D environments. However, extracting a radiance field of one specific objec…

cs.LG2023

PopSparse: Accelerated block sparse matrix multiplication on IPU

Zhiyi Li, Douglas Orr, Valeriu Ohan +5

Reducing the computational cost of running large scale neural networks using sparsity has attracted great attention in the deep learning community. While much success has been achi…

cs.LG2023★ 2 cited

GPS++: Reviving the Art of Message Passing for Molecular Property Prediction

Dominic Masters, Josef Dean, Kerstin Klaser +9

We present GPS++, a hybrid Message Passing Neural Network / Graph Transformer model for molecular property prediction. Our model integrates a well-tuned local message passing compo…

q-bio.QM2022★ 10 cited

GPS++: An Optimised Hybrid MPNN/Transformer for Molecular Property Prediction

Dominic Masters, Josef Dean, Kerstin Klaser +7

This technical report presents GPS++, the first-place solution to the Open Graph Benchmark Large-Scale Challenge (OGB-LSC 2022) for the PCQM4Mv2 molecular property prediction task.…