atomate2.vasp.schemas#

Output schemas for VASP calculations.

Modules

atomate2.vasp.schemas.calc_types

Module defining vasp calculation types.

atomate2.vasp.schemas.calculation

Core definitions of a VASP calculation documents.

atomate2.vasp.schemas.defect

Schemas for defect documents.

atomate2.vasp.schemas.elph

Schemas for electron-phonon renormalisation documents.

atomate2.vasp.schemas.phonons

atomate2.vasp.schemas.task

Core definition of a VASP task document.