Skip to main content
. Author manuscript; available in PMC: 2017 Aug 21.
Published in final edited form as: Phys Chem Chem Phys. 2016 Jul 19;18(31):21686–21709. doi: 10.1039/c6cp01831a

Fig. 5.

Fig. 5

(left) Correlation of the errors predicted with the two-body fragment and cluster/fragment PBE0 models and (right) correlation of the errors between the PBE0 and B3LYP functionals with two-body fragment (or cluster/fragment for oxygen) models. The shaded region indicates ±RMSE from the model on the y-axis for a visual guide.