"SE(3)-equivariant prediction of molecular wavefunctions and electronic ..."

Oliver T. Unke et al. (2021)

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access: open

type: Conference or Workshop Paper

metadata version: 2024-10-06

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Oliver T. Unke, Mihail Bogojeski, Michael Gastegger, Mario Geiger, Tess E. Smidt, Klaus-Robert Müller:
SE(3)-equivariant prediction of molecular wavefunctions and electronic densities. NeurIPS 2021: 14434-14447

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