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The BHPERI subset - Results for B1B95

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.

B1B95 B1B95-D3
# Result Res. - Ref. Result Res. - Ref.
1 36.45 1.1075 36.47 1.1321
2 29.67 -1.2548 29.21 -1.7056
3 25.98 -2.3224 26.22 -2.0762
4 37.42 -2.1368 37.26 -2.2993
5 24.31 -3.8654 24.54 -3.6399
6 34.59 -1.0467 33.12 -2.5189
7 23.31 1.1665 18.92 -3.2232
8 19.73 1.4669 15.00 -3.2608
9 18.13 8.3270 11.30 1.5006
10 28.51 4.9622 28.32 4.7685
11 29.93 3.6314 27.67 1.3714
12 22.79 4.6932 20.44 2.3404
13 17.90 5.6957 15.02 2.8160
14 16.00 4.9019 13.33 2.2267
15 10.01 4.7056 7.28 1.9826
16 8.70 4.6964 5.68 1.6825
17 15.10 3.6033 11.75 0.2468
18 8.23 4.2321 4.58 0.5818
19 3.18 4.5836 -0.47 0.9349
20 19.80 4.8164 15.11 0.1235
21 17.55 4.0241 12.93 -0.5996
22 25.12 5.3071 21.09 1.2863
23 31.11 5.7519 26.75 1.3988
24 23.70 5.5949 19.23 1.1253
25 23.84 5.6423 18.89 0.7001
26 34.57 6.4935 29.82 1.7499
MD 3.26 0.33
MAD 4.08 1.82
RMSD 4.47 2.12