jaxrts.helpers.orbital_map

jaxrts.helpers.orbital_map = {'1s': 0, '2p': 2, '2s': 1, '3d': 5, '3p': 4, '3s': 3, '4d': 8, '4f': 9, '4p': 7, '4s': 6}

Typically, we return quantities that differ per orbital in an jax.numpy.ndarray with 10 entries, the orbitals with n<=4. This dictionary contains the orbitals as keys and the corresponding indices in such arrays as values.