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The WATER27 subset - Results for HF

All results were obtained with the aug-def2-TZVPP and aug-def2-QZVP basis sets and extrapolated to the CBS limit.
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.

HF HF-D3 HF-D3(BJ)
# Result Res. - Ref. Result Res. - Ref. Result Res. - Ref.
1 3.44 -1.5730 4.27 -0.7436 5.16 0.1506
2 9.80 -6.0047 12.46 -3.3367 15.98 0.1765
3 17.35 -10.0512 21.41 -5.9901 26.68 -0.7226
4 23.18 -12.7220 28.06 -7.8359 34.66 -1.2411
5 27.48 -18.5155 37.63 -8.3741 46.26 0.2616
6 27.49 -18.3140 36.99 -8.8103 45.62 -0.1803
7 28.28 -17.0167 35.80 -9.4982 44.26 -1.0423
8 29.21 -15.0871 34.89 -9.4130 42.80 -1.5003
9 43.35 -29.2528 57.96 -14.6427 71.45 -1.1485
10 43.29 -29.3090 57.91 -14.6885 71.40 -1.2027
11 120.71 -79.3930 154.96 -45.1450 190.73 -9.3691
12 121.50 -91.0970 169.55 -43.0475 207.29 -5.3129
13 122.45 -92.5512 168.07 -46.9325 205.27 -9.7260
14 124.52 -93.3813 168.45 -49.4503 206.20 -11.7006
15 29.07 -4.4274 30.03 -3.4724 32.36 -1.1414
16 50.51 -6.3893 52.45 -4.4455 56.32 -0.5847
17 68.40 -8.1042 71.43 -5.0702 76.54 0.0363
18 95.84 -21.9550 106.06 -11.7410 117.11 -0.6932
19 96.50 -18.4014 103.81 -11.0932 113.31 -1.5897
20 21.62 -4.9761 22.27 -4.3319 24.42 -2.1815
21 41.56 -6.8437 43.06 -5.3372 46.73 -1.6739
22 57.90 -9.6988 60.95 -6.6493 65.90 -1.7036
23 71.45 -13.3542 78.35 -6.4503 84.72 -0.0769
24 69.10 -15.6998 76.95 -7.8543 84.39 -0.4139
25 80.64 -20.0602 91.87 -8.8276 101.66 0.9609
26 90.66 -25.0424 104.12 -11.5798 116.06 0.3566
27 42.59 14.0886 45.98 17.4836 42.21 13.7098
MD -24.26 -12.49 -1.39
MAD 25.31 13.79 2.55
RMSD 37.45 19.66 4.55