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 | flumiclorac-pentyl_CONF133_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1805.18563083; Eh | ||||
| 13-Mar-2025 | flumiclorac-pentyl_CONF135_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1805.18259721; Eh | ||||
| 13-Mar-2025 | flumiclorac-pentyl_CONF126_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1805.18504760; Eh | ||||
| 13-Mar-2025 | flumiclorac-pentyl_CONF106_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1805.18210650; Eh | ||||
| 13-Mar-2025 | flumiclorac-pentyl_CONF103_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1805.18456851; Eh | ||||
| 13-Mar-2025 | flumiclorac-pentyl_CONF1_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1805.18627092; Eh | ||||
| 13-Mar-2025 | epyrifenacil_CONF99_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2285.31137028; Eh | ||||
| 13-Mar-2025 | epyrifenacil_CONF57_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2285.31057551; Eh | ||||
| 13-Mar-2025 | epyrifenacil_CONF58_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2285.31102506; Eh | ||||
| 13-Mar-2025 | epyrifenacil_CONF73_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2285.31085983; Eh |
Results 1591-1600 of 3134 (Search time: 0.001 seconds).
Discover
Calculation type