atomate2.vasp.jobs.mpΒΆ

Module defining Materials Project job makers.

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

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

Classes

MPGGARelaxMaker

Maker to create VASP relaxation job using PBE GGA by default.

MPGGAStaticMaker

Maker to create VASP static job using PBE GGA by default.

MPMetaGGARelaxMaker

Maker to create VASP relaxation job using r2SCAN by default.

MPMetaGGAStaticMaker

Maker to create VASP static job using r2SCAN by default.

MPPreRelaxMaker

Maker to create VASP pre-relaxation job using PBEsol by default.

TYPE_CHECKING

bool(x) -> bool