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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 18-Nov-2019 | Ti_d5d_Cp1 | Vlahovic, Filip | ADF; 2013; 01 | Single point | DFT | TZP | - | |||
 | 18-Nov-2019 | Ti_d5d_Cp2_EDA | Vlahovic, Filip | ADF; 2013; 01 | Single point | DFT | - | - | |||
 | 18-Nov-2019 | Ti_d5h_f1 | Vlahovic, Filip | ADF; 2013; 01 | Single point | DFT | TZP | - |
Results 111-113 of 113 (Search time: 0.001 seconds).
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Subject
- 86 Biomimetic
- 86 Caechol
- 86 Cathecholase
- 86 DFT
- 86 oxidation
Method
- 113 DFT