MolecularVibrations

Properties and Methods

 

__init__(self, molecule, basis, freqs=None, init=None):

Sets up a vibration for a Molecule object over the CoordinateSystem basis

  • molecule: Molecule

    No description…

  • init: None | CoordinateSet

    No description…

  • basis: MolecularNormalModes

    No description…

 

@property
basis(self):

 

@property
molecule(self):

 

@property
coords(self):

 

__len__(self):

 

displace(self, displacements=None, amt=0.1, n=1, which=0):

 

visualize(self, step_size=0.1, steps=(5, 5), which=0, anim_opts=None, mode='fast', **plot_args):

Examples

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