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. |
---|---|---|---|---|---|---|---|---|---|---|---|
6-Dec-2023 | plus-0_10 | Vlaisavljevich, Bess | TURBOMOLE; 7.3 | Restricted geometry optimization | U-DFT | def-TZVP; def2-TZVP | -1026.335871500; Eh | ||||
6-Dec-2023 | minus-0_05 | Vlaisavljevich, Bess | TURBOMOLE; 7.3 | Restricted geometry optimization | U-DFT | def-TZVP; def2-TZVP | -1026.336400552; Eh | ||||
6-Dec-2023 | minus-0_10 | Vlaisavljevich, Bess | TURBOMOLE; 7.3 | Restricted geometry optimization | U-DFT | def-TZVP; def2-TZVP | -1026.335778250; Eh | ||||
6-Dec-2023 | plus-0_05 | Vlaisavljevich, Bess | TURBOMOLE; 7.3 | Restricted geometry optimization | U-DFT | def-TZVP; def2-TZVP | -1026.336394729; Eh |
Results 1-4 of 4 (Search time: 0.001 seconds).
Discover
Subject
Program name