GMTKN55 AL2X6

References

GMTKN55: https://www.chemie.uni-bonn.de/grimme/de/software/gmtkn/gmtkn55

L. Goerigk, A. Hansen. C. A. Bauer, S. Ehrlich, A. Najibi and S. Grimme in Phys. Chem. Chem. Phys., 2017: https://doi.org/10.1039/C7CP04913G

Molecules

alf3 al2me4 al2me5 alh3 al2f6 al2me6 al2cl6 alme3 alcl3 al2h6 alme2

Reactions

1: al2h6 -> 2alh3, energy = 0.06135365544

2: al2f6 -> 2alf3, energy = 0.08222983430400001

3: al2cl6 -> 2alcl3, energy = 0.0517920468

4: al2me4 -> 2alme2, energy = 0.061194295296

5: al2me5 -> alme2 + alme3, energy = 0.049720364928

6: al2me6 -> 2alme3, energy = 0.036812193264