GMTKN55 BHPERI
--------------
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
| L. Goerigk; S. Grimme, J. Chem. Theory Comput., 2010, 6, 107-126: https://doi.org/10.1021/ct900489g

Molecules
^^^^^^^^^
01ts
13ts_2a
Cis-triscyclopropacyclohexane
13ts_8a
1,3-Cyclopentadiene
13ts_1a
05ts
1,3-Butadiene
07r
04r
TS5
TS2
02ts
00r
08ts
TS3
TS4
09r
Cyclohexene
06ts
03r
13ts_5a
13r_8
13r_1
1,3-Cyclohexadiene
13r_6
1,3-Pentadiene
ortho-xylylene
13r_7
13ts_6a
13r_9
cis-1,3,5-Hexatriene
Cyclonona-1,4,7-triene
13ts_7a
09ts
03ts
07ts
13ts_4a
Norbornene
02r
Cyclobutene
01r
05r
TS8
TS1
TS6
Benzocyclobutane
Ethylene
1,5-Hexadiene
TS7
04ts
TS9
13_c2h4
TS11
13r_5
13r_2
13ts_3a
TS10
13r_3
13r_4
13ts_9a

Reactions
^^^^^^^^^
| 1: Cyclobutene -> TS1, energy = 0.056254130831999996
| 2: cis-1,3,5-Hexatriene -> TS2, energy = 0.049082924352
| 3: ortho-xylylene -> TS3, energy = 0.044780200464000004
| 4: 1,3-Pentadiene -> TS4, energy = 0.063265977168
| 5: 1,3-Cyclopentadiene -> TS5, energy = 0.045098920752000005
| 6: 1,5-Hexadiene -> TS6, energy = 0.057050931551999993
| 7: 1,3-Butadiene + Ethylene -> TS7, energy = 0.035537312112
| 8: 1,3-Cyclopentadiene + Ethylene -> TS8, energy = 0.02868482592
| 9: 21,3-Cyclopentadiene -> TS11, energy = 0.02310722088
| 10: Cis-triscyclopropacyclohexane -> TS9, energy = 0.042071078016
| 11: 13r_1 + 13_c2h4 -> 13ts_1a, energy = 0.043983399744
| 12: 13r_2 + 13_c2h4 -> 13ts_2a, energy = 0.0318720288
| 13: 13r_3 + 13_c2h4 -> 13ts_3a, energy = 0.021991699872
| 14: 13r_4 + 13_c2h4 -> 13ts_4a, energy = 0.018804496992
| 15: 13r_5 + 13_c2h4 -> 13ts_5a, energy = 0.010358409360000001
| 16: 13r_6 + 13_c2h4 -> 13ts_6a, energy = 0.0074899267680000004
| 17: 13r_7 + 13_c2h4 -> 13ts_7a, energy = 0.020876178864
| 18: 13r_8 + 13_c2h4 -> 13ts_8a, energy = 0.009402248496
| 19: 13r_9 + 13_c2h4 -> 13ts_9a, energy = 0.00079680072
| 20: 02r + 00r -> 02ts, energy = 0.028844186064000004
| 21: 03r + 00r -> 03ts, energy = 0.026453783904
| 22: 04r + 00r -> 04ts, energy = 0.036493472975999995
| 23: 05r + 00r -> 06ts, energy = 0.044302120032
| 24: 07r + 00r -> 07ts, energy = 0.033943710672
| 25: 07r + 00r -> 08ts, energy = 0.034421791104
| 26: 09r + 00r -> 09ts, energy = 0.049879725072