atomate2.vasp.sets.mpΒΆ

Module defining Materials Project input set generators.

Reference: https://doi.org/10.1103/PhysRevMaterials.6.013801

In case of questions, consult @Andrew-S-Rosen, @esoteric-ephemera or @janosh.

Classes

MPGGARelaxSetGenerator

Class to generate MP-compatible VASP GGA relaxation input sets.

MPGGAStaticSetGenerator

Class to generate MP-compatible VASP GGA static input sets.

MPMetaGGARelaxSetGenerator

Class to generate MP-compatible VASP metaGGA relaxation input sets.

MPMetaGGAStaticSetGenerator

Class to generate MP-compatible VASP GGA static input sets.