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HEAVYSB11 results

Density functional: revPBE

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 geh3 ge2h6 2 -1 73.82 -8.33 -6.31 -5.45
2 snme3 sn2me6 2 -1 61.74 -10.33 -6.17 -5.32
3 pbme3 pb2me6 2 -1 52.92 -14.01 -9.83 -8.37
4 sh h2s2 2 -1 67.85 -2.73 -1.85 0.18
5 seh h2se2 2 -1 58.37 -2.76 -1.69 0.21
6 teme te2me2 2 -1 52.91 -3.98 -0.95 1.01
7 pme2 p2me4 2 -1 61.85 -13.10 -6.16 -3.57
8 asme2 as2me4 2 -1 52.18 -11.12 -3.99 -1.76
9 sbme2 sb2me4 2 -1 43.79 -7.96 -1.99 0.53
10 cl cl2 2 -1 59.65 0.54 0.56 2.15
11 br br2 2 -1 53.17 -0.48 -0.42 1.34
MD -6.75 -3.53 -1.73
MAD 6.85 3.63 2.72
RMSD 8.33 4.67 3.71