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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_CONF32_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2010.47496156; Eh | ||||
| 13-Mar-2025 | cinidon-ethyl_CONF34_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2010.47456247; Eh | ||||
| 13-Mar-2025 | cinidon-ethyl_CONF42_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2010.48481293; Eh | ||||
| 13-Mar-2025 | carfentrazone-ethyl_CONF353_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.10786535; Eh | ||||
| 13-Mar-2025 | carfentrazone-ethyl_CONF33_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.10753100; Eh | ||||
| 13-Mar-2025 | carfentrazone-ethyl_CONF36_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.10755098; Eh | ||||
| 13-Mar-2025 | carfentrazone-ethyl_CONF43_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.10790227; Eh | ||||
| 13-Mar-2025 | carfentrazone-ethyl_CONF320_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.10561484; Eh | ||||
| 13-Mar-2025 | carfentrazone-ethyl_CONF295_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.10586002; Eh | ||||
| 13-Mar-2025 | carfentrazone-ethyl_CONF293_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.10451144; Eh |
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