Author

R. LaCour

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Open access Oct 2026

Intrinsic physicochemical activity at microplastic–water interfaces

Plastics have become an integral part of our modern society, largely because they are generally regarded as chemically inert under normal circumstances. However, plastics fragmented into microplastics (less than 5 mm in size) have recently raised significant public concerns, and have been detected widely across ecosyst...

Nai-Xin Qian, Ruo-Qi Zhao, Kwing Yeung Chan et al. · Nature · 0 citations

Preprint Sep 2026

ECENet: An Edge Cluster Expansion Line-Graph Neural Network

Machine-learned interatomic potentials (MLIPs) have emerged as a promising alternative to classical force fields and first-principles theory for predicting the properties of chemical and material systems. Many MLIPs are graph neural networks with O(3)-equivariant features, whose accuracy comes at substantial computatio...

R. LaCour, Teresa Head-Gordon · 0 citations