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NBPRC results

Density functional: M06L

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.

-0.64 -4.67 2.54 -4.47 4.88 -6.14
# Systems Stoichiometry Ref. without D3(0)
1 BH3PH3 BH3 PH3 1 -1 -1 -25.2 0.41 0.40
2 K_H BH3PH3 H2 1 -1 -1 40.4 3.57 3.58
3 BF3PMe3 BF3 PMe3 1 -1 -1 -15.2 2.23 2.23
4 K_F BF3PMe3 H2 1 -1 -1 18.5 1.58 1.53
5 BCl3PMe3 BCl3 PMe3 1 -1 -1 -31.2 11.26 11.17
6 K_Cl BCl3PMe3 H2 1 -1 -1 17.6 6.08 5.82
-0.67
-4.70
2.26
-4.54
4.54
-6.24
MD 1.39 1.28
MAD 4.04 3.97
RMSD 4.95 4.89