atomate2.vasp.setsΒΆ
Module defining VASP input sets used in atomate2.
Modules
Module defining base VASP input set and generator. |
|
Module defining core VASP input set generators. |
|
Module defining VASP input set generators for defect calculations. |
|
Module defining equation of state (EOS) parameter sets. |
|
Module defining MatPES input set generators. |
|
Module defining Materials Project input set generators. |
|
Sets for the MPMorph amorphous workflows. |