GMTKN55 ALK8

References

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

li+ li8 li_h na2_h2 na+ na8 li2_ch2n_2 li2_ch4 li_ch2n li4_c li_me li2 li5_ch li4_me4 na2 li_na_h2 li3_me

Reactions

1: li8 -> 4li2, energy = 0.1377987165168
2: na8 -> 4na2, energy = 0.084699916536
3: li4_me4 -> 4li_me, energy = 0.2089689568272
4: li3_me -> li_me + li2, energy = 0.0549951856944
5: li2_ch4 -> li_me + li_h, energy = 0.0755685802848
6: li5_ch -> li4_c + li_h, energy = 0.10562390344320001
7: li2_ch2n_2 -> 2li_ch2n, energy = 0.090118161432
8: na+ + li_na_h2 -> li+ + na2_h2, energy = 0.040318116432