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 | butafenacil_CONF546_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2093.80640201; Eh | |||
 | 13-Mar-2025 | butafenacil_CONF491_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2093.80745122; Eh | |||
 | 13-Mar-2025 | butafenacil_CONF445_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2093.80551722; Eh | |||
 | 13-Mar-2025 | butafenacil_CONF449_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2093.80512491; Eh | |||
 | 13-Mar-2025 | butafenacil_CONF408_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2093.80584433; Eh | |||
 | 13-Mar-2025 | butafenacil_CONF400_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2093.80649199; Eh | |||
 | 13-Mar-2025 | butafenacil_CONF42_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2093.80622114; Eh | |||
 | 13-Mar-2025 | butafenacil_CONF237_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2093.80408143; Eh | |||
 | 13-Mar-2025 | butafenacil_CONF241_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2093.80576094; Eh | |||
 | 13-Mar-2025 | butafenacil_CONF24_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2093.80547012; Eh |
Results 2451-2460 of 3134 (Search time: 0.003 seconds).
Discover
Calculation type