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. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 13-Mar-2025 | carfentrazone-ethyl_CONF2_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.09121690; Eh | |||
 | 13-Mar-2025 | butafenacil_CONF813_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2093.80668320; Eh | |||
 | 13-Mar-2025 | butafenacil_CONF815_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2093.80662449; Eh | |||
 | 13-Mar-2025 | butafenacil_CONF790_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2093.80580801; Eh | |||
 | 13-Mar-2025 | butafenacil_CONF798_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2093.80730106; Eh | |||
 | 13-Mar-2025 | butafenacil_CONF787_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2093.80427749; Eh | |||
 | 13-Mar-2025 | butafenacil_CONF797_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2093.80537905; Eh | |||
 | 13-Mar-2025 | butafenacil_CONF731_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2093.80484267; Eh | |||
 | 13-Mar-2025 | butafenacil_CONF734_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2093.80596084; Eh | |||
 | 13-Mar-2025 | butafenacil_CONF726_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2093.80512685; Eh |
Results 2391-2400 of 3134 (Search time: 0.002 seconds).
Discover
Calculation type