AIMNet2-rxn: A Machine Learned Potential for Generalized Reaction Modeling on a Millions-of-Pathways Scale
Dylan M. Anstine(Carnegie Mellon University), Olexandr Isayev(Carnegie Mellon University), Filipp Nikitin(Carnegie Mellon University), Qiyuan Zhao(Purdue University West Lafayette), Veerupaksh Singla(University of Notre Dame), Roman Zubatiuk(Carnegie Mellon University), Shuhao Zhang(Soochow University), Brett M. Savoie(University of Notre Dame)
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