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G2RC results

Density functional: revTPSS0

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(0) D3(BJ)
1 118 117 13 -1 1 1 -2.23 2.47 3.78 4.04
2 40 1 104 -1 -1 1 -2.26 2.68 2.35 2.31
3 113 30 8 -1 1 1 -2.18 3.26 3.99 4.17
4 52 1 18 -1 -1 2 -4.10 -3.12 -2.69 -1.27
5 30 13 40 1 -1 -1 1 1 -7.10 -10.64 -10.70 -10.81
6 128 13 126 22 -1 -1 1 1 -10.70 -1.81 -1.77 -1.19
7 100 13 106 -1 -1 1 -19.47 -7.03 -8.08 -8.10
8 25 14 121 -1 -1 1 -26.97 -9.73 -10.15 -10.26
9 39 45 51 -1 -1 2 -27.30 -0.13 -0.12 0.34
10 58 59 57 60 -1 -1 1 1 -27.15 -3.87 -4.23 -4.42
11 67 61 66 62 -1 -1 1 1 -24.89 11.97 12.65 13.22
12 32 1 33 -1 -1 1 -29.46 2.17 1.88 1.85
13 25 26 88 -1 -1 1 -32.71 -6.79 -7.90 -8.45
14 47 1 18 13 -1 -3 1 1 -36.32 -6.72 -7.12 -7.33
15 34 1 11 -1 -3 2 -39.43 7.35 7.32 7.03
16 8 45 97 22 -1 -2 1 2 -48.52 5.31 4.69 4.80
17 25 1 26 -1 -1 1 -49.20 -2.80 -3.01 -3.24
18 56 1 21 13 -1 -3 1 2 -61.67 11.42 11.50 11.69
19 30 1 13 8 -1 -3 1 1 -65.15 5.14 5.08 4.80
20 73 1 39 13 -1 -1 1 1 -68.90 10.93 11.01 11.00
21 68 1 34 13 -1 -1 1 1 -81.21 13.48 13.57 13.69
22 26 6 82 -1 -1 1 -109.11 -5.59 -6.30 -6.57
23 1 39 14 -1 -1 2 -135.40 11.67 11.68 11.69
24 25 94 -3 1 -154.04 -13.93 -15.69 -18.36
25 23 39 24 -1 -1 2 -216.11 12.18 12.20 12.73
MD 1.12 0.96 0.93
MAD 6.89 7.18 7.33
RMSD 8.02 8.35 8.68