324 citations · 348 across the 6 of their papers we have counts for
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physics.chem-ph2022★ 2 cited
Open Challenges in Developing Generalizable Large Scale Machine Learning Models for Catalyst Discovery
Adeesh Kolluru, Muhammed Shuaibi, Aini Palizhati +6
The development of machine learned potentials for catalyst discovery has predominantly been focused on very specific chemistries and material compositions. While effective in inter…
cond-mat.mtrl-sci2022★ 324 cited
The Open Catalyst 2022 (OC22) Dataset and Challenges for Oxide Electrocatalysts
Richard Tran, Janice Lan, Muhammed Shuaibi +14
The development of machine learning models for electrocatalysts requires a broad set of training data to enable their use across a wide variety of materials. One class of materials…