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AL2X6 results

Density functional: B97-2

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 al2h6 alh3 -1 2 38.5 -3.20 -1.77 9.81
2 al2f6 alf3 -1 2 51.6 -7.78 -5.70 5.18
3 al2cl6 alcl3 -1 2 32.5 -8.69 -2.91 15.19
4 al2me4 alme2 -1 2 38.4 -5.33 -1.67 9.92
5 al2me5 alme2 alme3 -1 1 1 31.2 -7.79 -2.07 12.25
6 al2me6 alme3 -1 2 23.1 -10.38 -2.34 14.90
MD -7.20 -2.74 11.21
MAD 7.20 2.74 11.21
RMSD 7.56 3.07 11.72