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The WATER27 subset - Results for BPBE

All results were obtained with the aug-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.

BPBE BPBE-D3
# Result Res. - Ref. Result Res. - Ref.
1 3.57 -1.4365 4.60 -0.4128
2 11.77 -4.0256 15.10 -0.6981
3 22.43 -4.9699 27.32 -0.0838
4 29.85 -6.0541 35.69 -0.2108
5 33.53 -12.4664 45.84 -0.1560
6 34.31 -11.4933 45.77 -0.0319
7 36.14 -9.1604 45.17 -0.1268
8 36.98 -7.3234 43.79 -0.5111
9 55.47 -17.1306 72.89 0.2945
10 55.45 -17.1525 72.89 0.2939
11 157.67 -42.4252 198.13 -1.9656
12 149.77 -62.8324 206.89 -5.7118
13 152.48 -62.5179 206.65 -8.3535
14 156.66 -61.2373 208.79 -9.1074
15 35.18 1.6764 36.33 2.8290
16 56.95 0.0512 59.26 2.3629
17 74.62 -1.8787 78.21 1.7146
18 106.78 -11.0234 118.98 1.1788
19 107.72 -7.1813 116.45 1.5499
20 27.66 1.0614 28.47 1.8684
21 47.96 -0.4364 49.80 1.4036
22 65.03 -2.5656 68.70 1.1031
23 76.52 -8.2760 85.00 0.2001
24 77.16 -7.6362 86.74 1.9354
25 88.57 -12.1274 102.41 1.7070
26 101.08 -14.6227 117.39 1.6920
27 16.07 -12.4258 20.36 -8.1383
MD -14.65 -0.57
MAD 14.86 2.06
RMSD 23.83 3.30