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DIPCS10 results

Density functional: BP86

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 -0.77 -0.73 -0.69
2 c2h6 c2h6_2+ -1 1 667.1 -7.69 -7.57 -7.65
3 c2h4 c2h4_2+ -1 1 655.8 -3.52 -3.57 -3.51
4 n2h2 n2h2_2+ -1 1 626.9 5.19 5.13 5.22
5 nh3 nh3_2+ -1 1 776.5 5.84 5.77 5.84
6 ch2o ch2o_2+ -1 1 747.6 -3.38 -3.66 -3.41
7 h2s h2s_2+ -1 1 733.0 3.13 3.10 3.13
8 ph3 ph3_2+ -1 1 649.6 2.76 2.55 2.77
9 mg mg_2+ -1 1 522.1 6.95 6.95 6.95
10 be be_2+ -1 1 634.8 -0.99 -0.99 -0.99
MD 0.75 0.70 0.77
MAD 4.02 4.00 4.02
RMSD 4.60 4.57 4.59