pythtb.TBModel.get_orb_vecs

TBModel.get_orb_vecs(cartesian=False)

Return orbital positions.

Changed in version 2.0.0: The name was changed from get_orb to get_orb_vecs.

Parameters:

cartesianbool, optional

If True, returns orbital positions in Cartesian coordinates. If False, returns reduced coordinates (default).

Added in version 2.0.0.

Returns:

np.ndarray

Array of orbital positions, shape (norb, dim_r).