mattertune.data.atoms_list

Classes

`AtomsListDataset`(config)
`AtomsListDatasetConfig`(*[, type])

class mattertune.data.atoms_list.AtomsListDatasetConfig(*, type='atoms_list', atoms_list)[source]

Parameters:

type (Literal['atoms_list'])
atoms_list (list[Atoms])

type: Literal['atoms_list']: Discriminator for the atoms_list dataset.

atoms_list: list[ase.Atoms]: The list of Atoms objects.

create_dataset()[source]

class mattertune.data.atoms_list.AtomsListDataset(config)[source]

Parameters:: config (AtomsListDatasetConfig)

__init__(config)[source]

Parameters:: config (AtomsListDatasetConfig)