GMTKN30 HEAVY28
References
L. Goerigk, and S. Grimme in Phys. J. Chem. Theory Comput., 2011: https://doi.org/10.1021/ct100466k
Molecules
bih3_nh3 bih3_hcl teh2_2 sbh3_hbr bih3_h2s pbh4_bih3 sbh3_h2s teh2_h2o sbh3_2 sbh3_nh3 bih3 hbr pbh4_hbr sbh3_hcl teh2_hcl bih3_h2o bih3_hbr bih3_hi pbh4_2 pbh4_h2o nh3 sbh3_hi teh2_hi teh2_nh3 pbh4_hi bih3_2 hi pbh4 pbh4_teh2 hcl teh2_hbr pbh4_hcl teh2_h2s sbh3 h2o teh2 h2s sbh3_h2o
Reactions
1: bih3_2 -> 2bih3, energy = 0.0020557458576
2: bih3_h2o -> bih3 + h2o, energy = 0.0038565154848
3: bih3_h2s -> bih3 + h2s, energy = 0.002231042016
4: bih3_hcl -> bih3 + hcl, energy = 0.001354561224
5: bih3_hbr -> bih3 + hbr, energy = 0.0018485776704
6: bih3_hi -> bih3 + hi, energy = 0.0022629140448
7: bih3_nh3 -> bih3 + nh3, energy = 0.0010995849935999998
8: pbh4_2 -> 2pbh4, energy = 0.0021035539008000003
9: pbh4_bih3 -> pbh4 + bih3, energy = 0.0010836489792000002
10: pbh4_h2o -> pbh4 + h2o, energy = 0.0007011846336
11: pbh4_hcl -> pbh4 + hcl, energy = 0.001274881152
12: pbh4_hbr -> pbh4 + hbr, energy = 0.0016573454976
13: pbh4_hi -> pbh4 + hi, energy = 0.0020557458576
14: pbh4_teh2 -> pbh4 + teh2, energy = 0.001115521008
15: sbh3_2 -> 2sbh3, energy = 0.002071681872
16: sbh3_h2o -> sbh3 + h2o, energy = 0.002709122448
17: sbh3_h2s -> sbh3 + h2s, energy = 0.0018167056416
18: sbh3_hcl -> sbh3 + hcl, energy = 0.0035059231680000004
19: sbh3_hbr -> sbh3 + hbr, energy = 0.0032987549808
20: sbh3_hi -> sbh3 + hi, energy = 0.0026135063615999998
21: sbh3_nh3 -> sbh3 + nh3, energy = 0.004462084032
22: teh2_2 -> 2teh2, energy = 0.0009242888352
23: teh2_h2o -> teh2 + h2o, energy = 0.0010836489792000002
24: teh2_h2s -> teh2 + h2s, energy = 0.00079680072
25: teh2_hcl -> teh2 + hcl, energy = 0.0019760657856
26: teh2_hbr -> teh2 + hbr, energy = 0.0019760657856
27: teh2_hi -> teh2 + hi, energy = 0.0013386252095999999
28: teh2_nh3 -> teh2 + nh3, energy = 0.0052429487376