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TAUT15 results

Density functional: MPW1B95

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 1a 1b -1 1 4.30 2.78 2.03 2.59
2 2a 2b -1 1 6.56 3.12 2.93 3.19
3 3a 3b -1 1 -5.44 -1.32 -1.46 -1.28
4 3a 3c -1 1 5.25 2.85 2.17 2.61
5 3a 3d -1 1 13.03 -0.26 -0.40 -0.27
6 4a 4b -1 1 0.93 -0.44 -0.64 -0.47
7 5a 5b -1 1 0.74 -0.57 -0.79 -0.62
8 5a 5c -1 1 1.45 0.69 0.30 0.59
9 6a 6b -1 1 -0.17 0.02 -0.26 -0.04
10 6a 6c -1 1 -0.87 0.04 -0.27 -0.03
11 6a 6d -1 1 2.85 0.13 0.11 0.11
i12 7a 7b -1 1 2.15 0.54 0.54 0.52
13 8a 8b -1 1 0.55 -0.08 -0.12 -0.10
14 9a 9b -1 1 0.95 0.17 0.23 0.19
15 10a 10b -1 1 -0.45 -1.29 -1.42 -1.30
MD 0.43 0.20 0.38
MAD 0.95 0.91 0.93
RMSD 1.42 1.25 1.38