GMTKN30 AL2X

References

GMTKN30: https://www.chemie.uni-bonn.de/grimme/de/software/gmtkn/gmtkn30

L. Goerigk, and S. Grimme in Phys. J. Chem. Theory Comput., 2011: https://doi.org/10.1021/ct100466k

Molecules

al2me6 alme2 al2me4 al2me5 al2h6 alh3 alcl3 al2cl6 al2f6 al2br6 alf3 alme3 albr3

Reactions

1: al2h6 -> 2alh3, energy = 0.057050931551999993

2: al2f6 -> 2alf3, energy = 0.083823435744

3: al2cl6 -> 2alcl3, energy = 0.050039085216

4: al2br6 -> 2albr3, energy = 0.045258280896

5: al2me4 -> 2alme2, energy = 0.060238134432

6: al2me5 -> alme2 + alme3, energy = 0.0478080432

7: al2me6 -> 2alme3, energy = 0.034103070815999996