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DIPCS10 results

Density functional: RPBE

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 c4h4 c4h4_2+ -1 1 529.2 -7.38 -7.44 -7.10
2 c2h6 c2h6_2+ -1 1 667.1 -11.77 -11.57 -11.61
3 c2h4 c2h4_2+ -1 1 655.8 -9.25 -9.33 -8.99
4 n2h2 n2h2_2+ -1 1 626.9 1.38 1.07 1.66
5 nh3 nh3_2+ -1 1 776.5 0.36 0.05 0.45
6 ch2o ch2o_2+ -1 1 747.6 -7.66 -7.76 -7.64
7 h2s h2s_2+ -1 1 733.0 -2.18 -2.25 -2.14
8 ph3 ph3_2+ -1 1 649.6 -2.73 -2.67 -2.48
9 mg mg_2+ -1 1 522.1 6.73 6.73 6.73
10 be be_2+ -1 1 634.8 2.56 2.56 2.56
MD -2.99 -3.06 -2.85
MAD 5.20 5.14 5.13
RMSD 6.35 6.34 6.24