AtomCharge Mulliken
Atomic charges derived from Mulliken population analysis.
Dipole
Dipole moment in atomic units.
FragmentCharge Hirshfeld
Fragment charges derived from Hirshfeld analysis
AtomCharge_initial Voronoi
Atomic charges derived from Voronoi analysis for the initial (sum-of-fragments) charge density
AtomCharge_SCF Voronoi
Similar as the previous item, but now for the SCF density
Electrostatic Pot. at Nuclei
Coulomb potentials at the positions of the atoms, not including the contribution from the nucleus itself
