xnn.common.data

Modules

ase_io	Read ASE-native structure data (extxyz, CIF, VASP, ...) into xnn.
atomic_data	The single data abstraction that flows through the whole library.
dataset	Datasets and graph batching.
elements	Element symbols and atomic numbers.
hub	Dataset hub: one-liner load_dataset() loading.
neighborlist	Periodic-boundary-aware neighbor list.
runner_io	Read and write the RuNNer input.data structure format.