GMTKN55 ALKBDE10

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

cao be lio mg na lif ca nao s f o h mgo mgs hf kf beo bef li k

Reactions

1: bef -> be + f, energy = 0.22103251972799998

2: beo -> be + o, energy = 0.169877913504

3: cao -> ca + o, energy = 0.153304458528

4: hf -> h + f, energy = 0.226450764624

5: kf -> k + f, energy = 0.1872481692

6: lif -> li + f, energy = 0.221829320448

7: lio -> li + o, energy = 0.1314721188

8: mgo -> mg + o, energy = 0.099122009568

9: mgs -> mg + s, energy = 0.090357201648

10: nao -> na + o, energy = 0.103902813888