atomate2.forcefields.neb¶
Run NEB with ML forcefields.
Classes
Run NEB with an ML forcefield using ASE. |
|
Run NEB with an ML forcefield using ASE. |
|
bool(x) -> bool |
Run NEB with ML forcefields.
Classes
Run NEB with an ML forcefield using ASE. |
|
Run NEB with an ML forcefield using ASE. |
|
bool(x) -> bool |