Wird geladen...
Structures and Energetics of Neutral and Cationic Pyrene Clusters
The low energy structures of neutral and cationic pyrene clusters containing up to seven molecules are searched through a global exploration scheme combining Parallel Tempering Monte Carlo algorithm and local quenches. The potential energies are computed at the Density Functional based Tight Binding...
Gespeichert in:
| Veröffentlicht in: | J Phys Chem A |
|---|---|
| Hauptverfasser: | , , |
| Format: | Artigo |
| Sprache: | Inglês |
| Veröffentlicht: |
2019
|
| Schlagworte: | |
| Online Zugang: | https://ncbi.nlm.nih.gov/pmc/articles/PMC6917508/ https://ncbi.nlm.nih.gov/pubmed/31589446 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acs.jpca.9b07007 |
| Tags: |
Tag hinzufügen
Keine Tags, Fügen Sie den ersten Tag hinzu!
|