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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
| 13-Mar-2025 | carfentrazone-ethyl_CONF186_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.10831577; Eh | ||||
| 13-Mar-2025 | carfentrazone-ethyl_CONF162_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.10823348; Eh | ||||
| 13-Mar-2025 | carfentrazone-ethyl_CONF165_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.10843251; Eh | ||||
| 13-Mar-2025 | carfentrazone-ethyl_CONF167_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.10824990; Eh | ||||
| 13-Mar-2025 | carfentrazone-ethyl_CONF152_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.10734039; Eh | ||||
| 13-Mar-2025 | carfentrazone-ethyl_CONF164_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.10846650; Eh | ||||
| 13-Mar-2025 | carfentrazone-ethyl_CONF138_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.10716245; Eh | ||||
| 13-Mar-2025 | carfentrazone-ethyl_CONF145_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.10669654; Eh | ||||
| 13-Mar-2025 | carfentrazone-ethyl_CONF139_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.10687085; Eh | ||||
| 13-Mar-2025 | carfentrazone-ethyl_CONF143_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.10693577; Eh |
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