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The G21IP subset - Results for B2PLYP

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. J. Chem. Theory Comput. 2011, 7, 291-309.

B2PLYP B2PLYP-D3
# Result Res. - Ref. Result Res. - Ref.
1 313.03 -1.8732 313.03 -1.8732
2 126.29 2.9901 126.29 2.9901
3 207.71 -7.1891 207.71 -7.1891
4 196.29 5.8913 196.29 5.8913
5 261.82 2.2210 261.82 2.2210
6 334.80 -0.5002 334.80 -0.5002
7 318.21 4.4055 318.21 4.4055
8 403.00 1.3024 403.00 1.3024
9 120.82 2.3236 120.82 2.3236
10 174.84 -1.4649 174.84 -1.4649
11 135.93 -2.0742 135.93 -2.0742
12 184.93 -3.0741 184.93 -3.0741
13 238.49 -3.4067 238.49 -3.4067
14 238.62 -0.3755 238.62 -0.3755
15 298.02 -1.0792 298.02 -1.0792
16 293.77 -2.5642 293.74 -2.5986
17 234.02 -1.6697 234.01 -1.6833
18 302.49 1.5718 302.49 1.5718
19 290.77 -1.8751 290.77 -1.8775
20 370.12 -1.1919 370.12 -1.1921
21 252.76 -2.6315 252.83 -2.5619
22 232.63 -1.4755 232.63 -1.4756
23 226.38 0.0120 226.38 0.0111
24 224.70 -3.1227 224.62 -3.2035
25 238.56 -0.7435 238.56 -0.7436
26 292.58 -1.8750 292.58 -1.8753
27 260.70 -3.8845 260.68 -3.9035
28 239.22 -4.4864 239.21 -4.5035
29 323.16 0.1769 323.16 0.1769
30 358.08 -1.2829 358.08 -1.2829
31 280.79 3.0583 280.79 3.0585
32 246.17 3.3184 246.17 3.3185
33 215.91 0.1747 215.91 0.1759
34 261.22 -3.8581 261.23 -3.8547
35 288.70 -2.9968 288.70 -2.9955
36 262.18 1.0261 262.18 1.0264
MD -0.73 -0.73
MAD 2.31 2.31
RMSD 2.80 2.80