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G21EA results

Density functional: DSD-PBEB95

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 EA_c EA_c- 1 -1 29.2 -4.34 -4.34
2 EA_o EA_o- 1 -1 33.7 -4.01 -4.01
3 EA_f EA_f- 1 -1 78.4 -3.53 -3.53
4 EA_si EA_si- 1 -1 32.1 -3.32 -3.32
5 EA_p EA_p- 1 -1 17.3 -2.40 -2.40
6 EA_s EA_s- 1 -1 48.0 -2.61 -2.61
7 EA_cl EA_cl- 1 -1 83.5 -2.37 -2.37
8 EA_8n EA_8 1 -1 27.9 -3.11 -3.11
9 EA_9n EA_9 1 -1 13.4 -2.05 -2.05
10 EA_10n EA_10 1 -1 1.2 -2.92 -2.92
11 EA_11n EA_11 1 -1 8.3 -3.57 -3.57
12 EA_12n EA_12 1 -1 16.8 -2.34 -2.34
13 EA_13n EA_13 1 -1 41.7 -3.03 -3.03
14 EA_14n EA_14 1 -1 29.3 -3.37 -3.37
15 EA_15n EA_15 1 -1 25.1 -2.74 -2.74
16 EA_16n EA_16 1 -1 31.4 -3.08 -3.08
17 EA_17n EA_17 1 -1 23.5 -2.58 -2.58
18 EA_18n EA_18 1 -1 28.8 -2.42 -2.42
19 EA_19n EA_19 1 -1 54.2 -3.32 -3.32
20 EA_20n EA_20 1 -1 9.5 -3.00 -3.00
21 EA_21n EA_21 1 -1 -0.2 -3.82 -3.82
22 EA_22n EA_22 1 -1 89.5 1.59 1.59
23 EA_23n EA_23 1 -1 24.9 -2.78 -2.78
24 EA_24n EA_24 1 -1 38.0 -2.57 -2.59
25 EA_25n EA_25 1 -1 54.7 -1.29 -1.40
MD -2.76 -2.76
MAD 2.89 2.89
RMSD 2.97 2.97