atomate2.common.flows.gruneisenΒΆ
Flows for calculating Grueneisen-Parameters.
Classes
Maker to calculate Grueneisen parameters with DFT/force field code and Phonopy. |
|
bool(x) -> bool |
Flows for calculating Grueneisen-Parameters.
Classes
Maker to calculate Grueneisen parameters with DFT/force field code and Phonopy. |
|
bool(x) -> bool |