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TAUT15 results

Density functional: B98

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 1.72 0.44 1.48
2 2a 2b -1 1 6.56 2.17 1.84 2.50
3 3a 3b -1 1 -5.44 -1.39 -1.62 -1.28
4 3a 3c -1 1 5.25 1.98 0.84 1.73
5 3a 3d -1 1 13.03 0.32 0.09 0.36
6 4a 4b -1 1 0.93 -1.29 -1.64 -1.30
7 5a 5b -1 1 0.74 -1.35 -1.73 -1.43
8 5a 5c -1 1 1.45 -0.32 -1.01 -0.48
9 6a 6b -1 1 -0.17 -0.67 -1.17 -0.76
10 6a 6c -1 1 -0.87 -0.64 -1.19 -0.80
11 6a 6d -1 1 2.85 0.02 -0.01 -0.05
i12 7a 7b -1 1 2.15 0.17 0.15 0.09
13 8a 8b -1 1 0.55 -0.06 -0.13 -0.10
14 9a 9b -1 1 0.95 0.64 0.75 0.73
15 10a 10b -1 1 -0.45 -1.86 -2.10 -1.79
MD -0.04 -0.43 -0.07
MAD 0.97 0.98 0.99
RMSD 1.21 1.19 1.22