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RG18 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 ne2 ne -1 2 0.08 -0.07 0.02 -0.02
2 ar2 ar -1 2 0.27 -0.33 -0.07 0.01
3 kr2 kr -1 2 0.40 -0.48 -0.05 0.11
4 ne3 ne -1 3 0.27 -0.24 0.03 -0.09
5 ar3 ar -1 3 0.77 -0.79 -0.15 0.05
6 kr3 kr -1 3 1.18 -1.29 -0.23 0.21
7 ne4 ne -1 4 0.54 -0.44 0.09 -0.15
8 ar4 ar -1 4 1.51 -1.66 -0.41 -0.02
9 ne6 ne -1 6 1.13 -0.96 0.13 -0.34
10 hfNe ne hf -1 1 1 0.23 -0.08 0.17 0.01
11 hfAr ar hf -1 1 1 0.59 -0.25 0.12 0.00
12 hfKr kr hf -1 1 1 0.72 -0.28 0.14 0.08
13 c2h2Ne ne c2h2 -1 1 1 0.12 -0.11 0.07 0.04
14 c2h2Ar ar c2h2 -1 1 1 0.33 -0.37 -0.00 0.04
15 c2h6Ne ne c2h6 -1 1 1 0.24 -0.23 0.10 -0.02
16 c2h6Ar ar c2h6 -1 1 1 0.54 -0.56 0.02 -0.01
17 bzNe ne bz -1 1 1 0.40 -0.35 0.11 0.03
18 bzAr ar bz -1 1 1 1.12 -1.23 -0.12 0.04
MD -0.54 0.00 0.00
MAD 0.54 0.11 0.07
RMSD 0.70 0.15 0.11