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UPU23 results

Density functional: MN15L

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)
1 2p 1a -1 1 4.87 -4.32 -4.31
2 2p 1b -1 1 2.97 -3.12 -3.11
3 2p 1c -1 1 8.90 -2.26 -2.25
4 2p 1g -1 1 2.22 -1.63 -1.62
5 2p 1p -1 1 2.02 -1.54 -1.53
6 2p 2a -1 1 3.14 -2.35 -2.36
7 2p 5z -1 1 0.57 -8.07 -8.05
8 2p 6p -1 1 3.32 -0.11 -0.11
9 2p 7a -1 1 7.26 -1.61 -1.60
10 2p aa -1 1 3.96 -3.26 -3.25
11 2p 1e -1 1 11.13 0.87 0.87
12 2p 0a -1 1 4.82 0.66 0.66
13 2p 1f -1 1 14.41 -1.58 -1.58
14 2p 9a -1 1 5.15 -2.44 -2.44
15 2p 4b -1 1 5.48 -0.14 -0.14
16 2p 3a -1 1 6.84 0.55 0.55
17 2p 7p -1 1 3.90 0.18 0.18
18 2p 8d -1 1 6.43 0.01 0.01
19 2p 3d -1 1 5.42 -0.09 -0.10
20 2p 0b -1 1 6.70 -1.44 -1.44
21 2p 1m -1 1 5.60 -0.25 -0.25
22 2p 2h -1 1 10.42 -1.49 -1.50
23 2p 3b -1 1 6.09 -0.52 -0.52
MD -1.48 -1.47
MAD 1.68 1.67
RMSD 2.44 2.44