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ACONF results

Density functional: DSD-BLYP

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 B_T B_G -1 1 0.598 0.13 0.05 0.01
2 P_TT P_TG -1 1 0.614 -0.18 -0.27 -0.31
3 P_TT P_GG -1 1 0.961 0.18 -0.09 -0.15
4 P_TT P_GX -1 1 2.813 0.12 -0.12 -0.18
5 H_ttt H_gtt -1 1 0.595 -0.20 -0.30 -0.34
6 H_ttt H_tgt -1 1 0.604 -0.09 -0.19 -0.23
7 H_ttt H_tgg -1 1 0.934 0.14 -0.18 -0.24
8 H_ttt H_gtg -1 1 1.178 0.12 -0.10 -0.17
9 H_ttt H_g+t+g- -1 1 1.302 -0.04 -0.21 -0.30
10 H_ttt H_ggg -1 1 1.250 0.39 -0.12 -0.19
11 H_ttt H_g+x-t+ -1 1 2.632 0.21 -0.08 -0.14
12 H_ttt H_t+g+x- -1 1 2.740 0.10 -0.17 -0.23
13 H_ttt H_g+x-g- -1 1 3.283 0.30 -0.05 -0.15
14 H_ttt H_x+g-g- -1 1 3.083 0.46 -0.05 -0.13
15 H_ttt H_x+g-x+ -1 1 4.925 0.46 -0.03 -0.13
MD 0.14 -0.13 -0.19
MAD 0.21 0.13 0.19
RMSD 0.24 0.16 0.21