Search
Add filters:
Use filters to refine the search results.
- previous
- 1
- next
Item hits:
| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 28-Nov-2024 | /No_solvation/Mg(pc)-CO2__assembly Mg(pc)-CO2_aug-cc-pVDZ_basis_set_for_optimization_of_S1_excited_ | Nesterova, Oksana | Orca; 6.0.1; RELEASE | Geometry optimization | DFT | aug-cc-pVDZ | -2053.99064775037550; Eh | |||
 | 28-Nov-2024 | /No_solvation/Mg(pc)-CO2__assembly Mg(pc)-CO2_aug-cc-pVDZ_basis_set_for_optimization | Nesterova, Oksana | Orca; 6.0.1; RELEASE | Geometry optimization | DFT | aug-cc-pVDZ | -2053.99063818357172; Eh |
Results 1-2 of 2 (Search time: 0.001 seconds).