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The ISO34 subset - Results for PBE

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.

PBE PBE-D
# Result Res. - Ref. Result Res. - Ref.
1 -3.00 -4.6223 -2.92 -4.5373
2 19.32 -2.5635 18.89 -2.9905
3 5.37 -1.8308 5.10 -2.1028
4 1.09 0.1024 0.76 -0.2306
5 0.37 -0.5561 0.98 0.0519
6 3.58 0.9598 3.24 0.6208
7 10.51 -0.6357 10.11 -1.0407
8 20.02 -2.8779 19.89 -3.0139
9 8.89 1.9532 8.65 1.7142
10 1.52 -2.0610 3.53 -0.0500
11 -5.32 -7.2312 2.28 0.3658
12 50.90 3.9548 49.87 2.9188
13 38.79 2.7468 37.92 1.8828
14 25.03 0.8252 24.99 0.7862
15 7.67 0.4148 7.62 0.3568
16 8.39 -2.4231 8.36 -2.4511
17 25.69 -1.2894 26.17 -0.8144
18 10.50 -0.6589 10.11 -1.0479
19 3.76 -0.8405 3.76 -0.8385
20 17.07 -3.1570 16.98 -3.2500
21 1.11 0.1694 0.97 0.0324
22 4.64 1.4066 4.84 1.6116
23 4.93 -0.3337 5.16 -0.1017
24 11.47 -1.0456 11.44 -1.0766
25 24.56 -1.9343 24.52 -1.9683
26 16.81 -1.3515 16.64 -1.5175
27 59.24 -4.9293 60.06 -4.1083
28 31.03 -0.1883 30.86 -0.3553
29 11.51 -0.3885 11.37 -0.5315
30 9.28 -0.2226 8.81 -0.6946
31 14.51 0.4641 15.29 1.2421
32 5.40 -1.6958 5.78 -1.3168
33 10.75 5.1334 9.46 3.8434
34 8.55 1.2949 8.89 1.6269
MD -0.69 -0.50
MAD 1.83 1.50
RMSD 2.48 1.94
max 5.13 3.84
min -7.23 -4.54