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The DC9 subset - Results for oPBE

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), root mean square (RMSD),
maximum (max) and minimum (min) deviations are shown.
The results were published in: Goerigk, L.; Grimme, S. J. Chem. Theory Comput. 2010, 6, 107-126.

oPBE oPBE-D
# Result Res. - Ref. Result Res. - Ref.
1 1.63 2.6264 1.99 2.9884
2 -24.49 -11.1857 -13.46 -0.1557
3 -1.46 12.8352 -1.50 12.8002
4 7.50 26.7049 -12.01 7.1859
5 -6.54 12.9646 -8.68 10.8166
6 -12.82 14.0809 -13.81 13.0859
7 -27.26 10.8448 -29.42 8.6788
8 -111.57 -23.1705 -111.64 -23.2445
9 -84.54 16.4596 -88.36 12.6446
MD 6.91 4.98
MAD 14.54 10.18
RMSD 15.99 11.96
max 26.70 13.09
min -23.17 -23.24