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S22 results

Density functional: M11

Reference values and deviations (result - reference) of the respective functional
w/o dispersion correction, D3(0) dispersion correction, and D3(BJ) dispersion correction in kcal/mol.

# Systems Stoichiometry Ref. without D3(BJ)
1 01 01a -1 2 3.133 -0.16 -0.10
2 02 02a -1 2 4.989 0.07 0.10
3 03 03a -1 2 18.753 0.70 0.89
4 04 04a -1 2 16.062 -0.29 -0.04
5 05 05a -1 2 20.641 -1.06 -0.47
6 06 06a 06b -1 1 1 16.934 -1.71 -0.98
7 07 07a 07b -1 1 1 16.66 -2.09 -1.27
8 08 08a -1 2 0.527 -0.18 -0.09
9 09 09a -1 2 1.472 -0.07 0.16
10 10 10a 10b -1 1 1 1.448 -0.31 0.03
11 11 11a -1 2 2.654 -0.74 0.47
12 12 12a -1 2 4.255 -0.94 0.06
13 13 13a -1 2 9.805 -0.88 0.49
14 14 14a 14b -1 1 1 4.524 -1.08 0.57
15 15 15a 15b -1 1 1 11.73 -0.32 1.63
16 16 16a 16b -1 1 1 1.496 -0.28 -0.11
17 17 17a 17b -1 1 1 3.275 0.22 0.43
18 18 18a 18b -1 1 1 2.312 -0.15 0.14
19 19 19a 19b -1 1 1 4.541 0.33 0.70
20 20 20a 20b -1 1 1 2.717 -0.73 0.09
21 21 21a 21b -1 1 1 5.627 -1.01 0.05
22 22 22a 22b -1 1 1 7.097 -0.90 -0.05
MD -0.53 0.12
MAD 0.65 0.41
RMSD 0.83 0.60