GMTKN55 UPU23
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
3b 5z 3d 0b 4b 1f 1a 1g 2h 2a 7p 9a 3a 6p 0a aa 1b 1e 1p 8d 1c 1m 2p 7a
Reactions
1: 2p -> 1a, energy = 0.0077608390128
2: 2p -> 1b, energy = 0.0047329962768
3: 2p -> 1c, energy = 0.014183052816
4: 2p -> 1g, energy = 0.0035377951968
5: 2p -> 1p, energy = 0.0032190749088000003
6: 2p -> 2a, energy = 0.005003908521600001
7: 2p -> 5z, energy = 0.0009083528208
8: 2p -> 6p, energy = 0.0052907567808
9: 2p -> 7a, energy = 0.0115695464544
10: 2p -> aa, energy = 0.0063106617024
11: 2p -> 1e, energy = 0.0177367840272
12: 2p -> 0a, energy = 0.007681158940800001
13: 2p -> 1f, energy = 0.0229637967504
14: 2p -> 9a, energy = 0.008207047416
15: 2p -> 4b, energy = 0.008732935891200002
16: 2p -> 3a, energy = 0.0109002338496
17: 2p -> 7p, energy = 0.006215045616
18: 2p -> 8d, energy = 0.0102468572592
19: 2p -> 3d, energy = 0.0086373198048
20: 2p -> 0b, energy = 0.010677129648
21: 2p -> 1m, energy = 0.008924168064
22: 2p -> 2h, energy = 0.0166053270048
23: 2p -> 3b, energy = 0.0097050327696