ASEDynamicsSupportsInteractions¶

class narupatools.ase.imd.ASEDynamicsSupportsInteractions(*args, **kwargs)¶

Wrapper around an ASE atoms object.

Inheritance

Inheritance diagram of ASEDynamicsSupportsInteractions

Methods

Initialize self.

__init__(*args, **kwargs)¶: Initialize self. See help(type(self)) for accurate signature.

Attributes

`atoms`	Wrapped ASE Atoms.
`elapsed_time`
`on_post_step`
`on_pre_step`
`on_reset`

atoms¶: Wrapped ASE Atoms.

elapsed_time¶

on_post_step¶

on_pre_step¶

on_reset¶