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HEAVYSB11 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 geh3 ge2h6 2 -1 73.82 -0.71 0.75
2 snme3 sn2me6 2 -1 61.74 -1.88 0.70
3 pbme3 pb2me6 2 -1 52.92 -3.08 0.19
4 sh h2s2 2 -1 67.85 -0.19 0.83
5 seh h2se2 2 -1 58.37 -0.68 0.82
6 teme te2me2 2 -1 52.91 -0.65 2.22
7 pme2 p2me4 2 -1 61.85 -1.62 1.24
8 asme2 as2me4 2 -1 52.18 -1.07 2.18
9 sbme2 sb2me4 2 -1 43.79 -1.42 2.21
10 cl cl2 2 -1 59.65 -0.50 0.08
11 br br2 2 -1 53.17 -1.59 -0.57
MD -1.22 0.97
MAD 1.22 1.07
RMSD 1.45 1.31