Exemplar pre-calculated molecular databases. All online available databases are listed at https://www.kingsbury.id.au/scsd_models_table.
| Molecular type | Name of example |
|---|---|
| Aromatics | Anthracene |
| Pyrene | |
| Coronenea | |
| Fluorophores | BODIPY |
| Xanthene | |
| Molecular electronics | Tetrathiafulvalene |
| Tetracyano-α,α′-quinodimethane | |
| Dihydroxy-p-benzoquinone | |
| Naphthalenediimide | |
| Porphyrinoids | Porphycene |
| Corrole | |
| Norcorrole | |
| Corrphycene | |
| Chlorin | |
| Phthalocyanine | |
| Other | Cucurbit[6]urila |
| Carbamazepine | |
| Salen | |
| β-Carotene | |
| Curcumin |
a
Additional approximations are used for non-perpendicular E-groups in D6h.