emmet.archival.vasp.volumetric

Classes

BandStructureArchive

Archive/extract an electronic bandstructure.

DosArchive

Archive/extract an electronic density of states (DOS).

PMG_OBJ

dict() -> new empty dictionary dict(mapping) -> new dictionary initialized from a mapping object's (key, value) pairs dict(iterable) -> new dictionary initialized as if via: d = {} for k, v in iterable: d[k] = v dict(**kwargs) -> new dictionary initialized with the name=value pairs in the keyword argument list. For example: dict(one=1, two=2).

TYPE_CHECKING

bool(x) -> bool

VASP_VOLUMETRIC_FILES

Built-in mutable sequence.

VaspVolumetricArchive

Archive all CHGCAR-like volumetric data associated with a VASP calculation.