Search
Add filters:
Use filters to refine the search results.
Item hits:
| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 27-Sep-2021 | O2mT_freq | D’Amore, Lorenzo | ADF; | Single point | BP86 | TZP; DZP | - | |||
 | 27-Sep-2021 | NaO2m_freq | D’Amore, Lorenzo | ADF; | Single point | BP86 | TZP; DZP | - |
Results 11-12 of 12 (Search time: 0.0 seconds).
Discover
Subject
- 12 Dicopper
- 12 Lewis acids
- 12 Oxidation
- 12 UV-vis spectroscopy
Method
- 8 BP86
- 4 S12g-x PBEc