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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_CONF111_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.10748543; Eh | |||
 | 13-Mar-2025 | carfentrazone-ethyl_CONF106_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.10622956; Eh | |||
 | 13-Mar-2025 | carfentrazone-ethyl_CONF110_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.10806658; Eh | |||
 | 13-Mar-2025 | carfentrazone-ethyl_CONF288_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.11469399; Eh | |||
 | 13-Mar-2025 | carfentrazone-ethyl_CONF283_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.11571887; Eh | |||
 | 13-Mar-2025 | carfentrazone-ethyl_CONF256_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.11732995; Eh | |||
 | 13-Mar-2025 | carfentrazone-ethyl_CONF257_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.11626069; Eh | |||
 | 13-Mar-2025 | carfentrazone-ethyl_CONF25_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.11748091; Eh | |||
 | 13-Mar-2025 | carfentrazone-ethyl_CONF217_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.09003657; Eh | |||
 | 13-Mar-2025 | carfentrazone-ethyl_CONF22_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.09210051; Eh |
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