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The PA subset - Results for CAM-B3LYP

All results were obtained with the def2-QZVP basis set.
For each data point of the subset, the actual result in Eh and the
deviation from the reference value (Res. - Ref.; in kcal/mol) are given.
At the end of the table, mean (MD), mean absolute (MAD) and root mean square (RMSD) deviations are shown.
The results were published in: Goerigk, L.; Grimme, S. Phys. Chem. Chem. Phys. 2011, DOI: 10.1039/C0CP02984J.

CAM-B3LYP CAM-B3LYP-D3
# Result Res. - Ref. Result Res. - Ref.
1 167.58 -0.2164 167.66 -0.1353
2 196.41 3.0110 196.61 3.2067
3 213.60 3.9045 213.81 4.1055
4 224.34 4.6391 224.54 4.8447
5 210.40 -1.4969 210.43 -1.4722
6 170.69 -0.9106 170.70 -0.8964
7 157.60 0.1989 157.67 0.2684
8 155.27 -1.5260 155.44 -1.3640
9 192.66 -0.0403 192.92 0.2243
10 173.51 -0.6872 173.57 -0.6254
11 136.81 -0.9936 136.83 -0.9699
12 103.70 -2.6048 103.70 -2.6046
MD 0.27 0.38
MAD 1.69 1.73
RMSD 2.23 2.30