Reference ABCAnimation

ABCAnimation

ABCAnimation(animation_dict, repeating_unitcell)

Contains an atomic simulation position with data from .xyz animation file.

Parameters:

• animation_dict (dict[int, ABCMolecule]) –

  Dictionary that contains xyz animation information. First image is key of 0 and keys are in order from 0-> # of images.

• repeating_unitcell (bool) –

  True if the unitcell is constant between the images. False if the unitcell is changes between the images.

Returns:

• ABCAnimation –

  ABCAnimation object that contains xyz animation information for dft calculation.