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ISOL24 results

Density functional: DSD-PBEP86

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 i1e i1p -1 1 71.01 0.88 2.22
2 i2e i2p -1 1 38.50 -2.51 0.83
3 i3e i3p -1 1 10.69 -0.68 -0.65
4 i4e i4p -1 1 69.03 -8.85 0.16
5 i5e i5p -1 1 33.08 0.59 1.94
6 i6e i6p -1 1 24.41 1.89 1.88
7 i7e i7p -1 1 17.88 -1.64 0.08
8 i8e i8p -1 1 22.04 6.68 3.96
9 i9e i9p -1 1 21.09 -0.36 0.56
10 i10e i10p -1 1 6.49 -0.19 0.46
11 i11e i11p -1 1 36.90 -1.91 -1.79
12 i12e i12p -1 1 0.42 0.05 0.02
13 i13e i13p -1 1 33.02 0.19 0.63
14 i14e i14p -1 1 5.32 -0.18 0.39
15 i15e i15p -1 1 4.14 -3.03 -2.17
16 i16e i16p -1 1 23.00 0.69 0.70
17 i17e i17p -1 1 9.83 -0.71 -0.23
18 i18e i18p -1 1 24.14 -2.61 -1.69
19 i19e i19p -1 1 18.04 -0.54 -0.29
20 i20e i20p -1 1 4.97 0.23 0.06
21 i21e i21p -1 1 11.90 -2.84 -1.47
22 i22e i22p 1 -1 0.14 5.06 3.21
23 i23e i23p -1 1 24.61 -2.31 -1.54
24 i24e i24p -1 1 15.40 -0.57 -0.02
MD -0.53 0.30
MAD 1.88 1.12
RMSD 2.87 1.53