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-Feb-2024 | GEOM07_TSRedEl_Ni4 | montilla, marc | Gaussian; 16; ES64L-G16RevA.03 | Geometry optimization TS | RBP86 | DEF2SVP | -2837.66872423; Eh | |||
 | 28-Feb-2024 | GEOM04_TSRedEl_Ni3 | montilla, marc | Gaussian; 16; ES64L-G16RevA.03 | Geometry optimization TS | UBP86 | DEF2SVP | -2837.85669991; Eh |
Results 1-2 of 2 (Search time: 0.0 seconds).