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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
| 13-Mar-2025 | cinidon-ethyl_CONF22_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2010.47572723; Eh | ||||
| 13-Mar-2025 | cinidon-ethyl_CONF14_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2010.47587120; Eh | ||||
| 13-Mar-2025 | cinidon-ethyl_CONF40_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2010.48785425; Eh | ||||
| 13-Mar-2025 | carfentrazone-ethyl_CONF206_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.10652393; Eh | ||||
| 13-Mar-2025 | carfentrazone-ethyl_CONF210_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.10672634; Eh | ||||
| 13-Mar-2025 | carfentrazone-ethyl_CONF213_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.10740832; Eh | ||||
| 13-Mar-2025 | carfentrazone-ethyl_CONF196_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.10703027; Eh | ||||
| 13-Mar-2025 | carfentrazone-ethyl_CONF198_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.10938507; Eh | ||||
| 13-Mar-2025 | carfentrazone-ethyl_CONF203_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.10808563; Eh | ||||
| 13-Mar-2025 | carfentrazone-ethyl_CONF190_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.10710418; Eh |
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