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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_CONF152_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.11733078; Eh | |||
 | 13-Mar-2025 | carfentrazone-ethyl_CONF164_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.11860485; Eh | |||
 | 13-Mar-2025 | butafenacil_CONF7_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2093.80708552; Eh | |||
 | 13-Mar-2025 | butafenacil_CONF69_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2093.80573206; Eh | |||
 | 13-Mar-2025 | butafenacil_CONF663_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2093.80525942; Eh | |||
 | 13-Mar-2025 | butafenacil_CONF500_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2093.80599635; Eh | |||
 | 13-Mar-2025 | butafenacil_CONF529_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2093.80640899; Eh | |||
 | 13-Mar-2025 | butafenacil_CONF535_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2093.80551455; Eh | |||
 | 13-Mar-2025 | butafenacil_CONF541_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2093.80693197; Eh | |||
 | 13-Mar-2025 | butafenacil_CONF507_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2093.80647134; Eh |
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