GMTKN30 SCONF
References
L. Goerigk, and S. Grimme in Phys. J. Chem. Theory Comput., 2011: https://doi.org/10.1021/ct100466k
Molecules
C1 C11 C7 C6 G3 G1 C13 C4 C15 G2 C12 C2 C9 C10 G4 C14 C3 C5 C8
Reactions
1: C1 -> C2, energy = 0.0013226891952
2: C1 -> C3, energy = 0.004143363744
3: C1 -> C4, energy = 0.0053704368528
4: C1 -> C5, energy = 0.0077608390128
5: C1 -> C6, energy = 0.0082548554592
6: C1 -> C7, energy = 0.007123398436799999
7: C1 -> C8, energy = 0.007458054739199999
8: C1 -> C9, energy = 0.0106611936336
9: C1 -> C10, energy = 0.01075680972
10: C1 -> C11, energy = 0.009689096755200001
11: C1 -> C12, energy = 0.009641288712
12: C1 -> C13, energy = 0.0098325208848
13: C1 -> C14, energy = 0.01075680972
14: C1 -> C15, energy = 0.0106930656624
15: G1 -> G2, energy = 0.00043027238880000005
16: G1 -> G3, energy = 0.0094341205248
17: G1 -> G4, energy = 0.008430151617600001