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. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 1-Oct-2019 | system_P_V-6a-radical | Miłaczewska, Anna | Gaussian; 09; ES64L-G09RevE.01 | Single point Structure | UB3LYP | - | -3904.427151; Eh | |||
 | 1-Oct-2019 | system_P_TS-rot | Miłaczewska, Anna | Gaussian; 09; ES64L-G09RevE.01 | Single point Structure | UB3LYP | - | -3753.9798317; Eh | |||
 | 1-Oct-2019 | system_P_y224a_P | Miłaczewska, Anna | Gaussian; 09; ES64L-G09RevE.01 | Single point Structure | UB3LYP | - | -3447.6294769; Eh | |||
 | 1-Oct-2019 | system_P_isopentenyl_rotation_V-c-radical | Miłaczewska, Anna | Gaussian; 09; ES64L-G09RevE.01 | Single point Structure | UB3LYP | - | -3904.416695; Eh | |||
 | 1-Oct-2019 | system_P_isopentenyl_rotation_TS-5b | Miłaczewska, Anna | Gaussian; 09; ES64L-G09RevE.01 | Single point Structure | UB3LYP | - | -3904.416934; Eh | |||
 | 1-Oct-2019 | system_P_isopentenyl_rotation_F-O2 | Miłaczewska, Anna | Gaussian; 09; ES64L-G09RevE.01 | Single point Structure | UB3LYP | - | -3904.4344619; Eh | |||
 | 1-Oct-2019 | system_P_isopentenyl_rotation_S-O2 | Miłaczewska, Anna | Gaussian; 09; ES64L-G09RevE.01 | Single point Structure | UB3LYP | - | -3904.4151674; Eh | |||
 | 1-Oct-2019 | system_P_y224a_S-oxo-rot | Miłaczewska, Anna | Gaussian; 09; ES64L-G09RevE.01 | Single point Structure | UB3LYP | - | -3447.6027899; Eh | |||
 | 1-Oct-2019 | system_P_V-5c-radical | Miłaczewska, Anna | Gaussian; 09; ES64L-G09RevE.01 | Single point Structure | UB3LYP | - | -3904.4171923; Eh | |||
 | 1-Oct-2019 | system_P_V-5a-radical | Miłaczewska, Anna | Gaussian; 09; ES64L-G09RevE.01 | Single point Structure | UB3LYP | - | -3904.4289386; Eh |
Results 21-30 of 51 (Search time: 0.0 seconds).