no code implementations • 5 Dec 2020 • Gowoon Cheon, Lusann Yang, Kevin McCloskey, Evan J. Reed, Ekin D. Cubuk
We illustrate the usage of the dataset by training graph neural networks to predict structural relaxations from randomly generated structures.
3 code implementations • 22 Feb 2018 • Nathaniel Thomas, Tess Smidt, Steven Kearnes, Lusann Yang, Li Li, Kai Kohlhoff, Patrick Riley
We introduce tensor field neural networks, which are locally equivariant to 3D rotations, translations, and permutations of points at every layer.