GMTKN55 PNICO23
---------------
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
^^^^^^^^^
16a
19b
3b
9b
13b
6a
15a
5a
10b
21a
22a
23b
20b
11a
20
18
4b
9
11
7
16
14b
1a
6
17
7b
12a
1
8a
10
19
8
21
2a
18a
17b
6b
9a
13a
19a
3a
16b
10a
5b
15b
21b
22b
23a
20a
1b
14a
4a
11b
23
4
15
3
12
17a
2b
18b
12b
2
8b
13
5
7a
14
22

Reactions
^^^^^^^^^
| 1: 1 -> 1a + 1b, energy = 0.0022788500591999997
| 2: 2 -> 2a + 2b, energy = 0.0127806835488
| 3: 3 -> 3a + 3b, energy = 0.0010199049216
| 4: 4 -> 4a + 4b, energy = 0.006788742134399999
| 5: 5 -> 5a + 5b, energy = 0.0045577001183999995
| 6: 6 -> 6a + 6b, energy = 0.0021035539008000003
| 7: 7 -> 7a + 7b, energy = 0.0068365501776
| 8: 8 -> 8a + 8b, energy = 0.0041911717872
| 9: 9 -> 9a + 9b, energy = 0.0078245830704
| 10: 10 -> 10a + 10b, energy = 0.0035218591824
| 11: 11 -> 11a + 11b, energy = 0.002231042016
| 12: 12 -> 12a + 12b, energy = 0.0041752357728000004
| 13: 13 -> 13a + 13b, energy = 0.0063425337312
| 14: 14 -> 14a + 14b, energy = 0.006533765903999999
| 15: 15 -> 15a + 15b, energy = 0.0069162302496
| 16: 16 -> 16a + 16b, energy = 0.0028366105632
| 17: 17 -> 17a + 17b, energy = 0.011314570224
| 18: 18 -> 18a + 18b, energy = 0.0037449633840000002
| 19: 19 -> 19a + 19b, energy = 0.009481928568
| 20: 20 -> 20a + 20b, energy = 0.0130356597792
| 21: 21 -> 21a + 21b, energy = 0.0078405190848
| 22: 22 -> 22a + 22b, energy = 0.0127966195632
| 23: 23 -> 23a + 23b, energy = 0.017481807796800003