pyscfad.ml.xtb.xtb_pad.XTB#

class pyscfad.ml.xtb.xtb_pad.XTB(mol, param=None, **kwargs)[source]#

Bases: XTB, SCF

Methods

dip_moment([mol, dm, unit, origin, verbose, ...])

Molecular dipole moment.

Parameters:

mol (MoleLite)
param (Any | None)