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_CONF83_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.10810238; Eh | |||
 | 13-Mar-2025 | carfentrazone-ethyl_CONF267_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.11590788; Eh | |||
 | 13-Mar-2025 | carfentrazone-ethyl_CONF36_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.09022281; Eh | |||
 | 13-Mar-2025 | carfentrazone-ethyl_CONF4_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.08986832; Eh | |||
 | 13-Mar-2025 | butafenacil_CONF745_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2093.80377267; Eh | |||
 | 13-Mar-2025 | butafenacil_CONF756_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2093.80655008; Eh | |||
 | 13-Mar-2025 | butafenacil_CONF748_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2093.80385818; Eh | |||
 | 13-Mar-2025 | butafenacil_CONF751_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2093.80419842; Eh | |||
 | 13-Mar-2025 | butafenacil_CONF707_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2093.80747735; Eh | |||
 | 13-Mar-2025 | butafenacil_CONF675_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2093.80580812; Eh |
Results 1861-1870 of 3134 (Search time: 0.002 seconds).
Discover
Calculation type