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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 13-Mar-2025 | butafenacil_CONF781_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2093.81690147; Eh | |||
 | 13-Mar-2025 | butafenacil_CONF604_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2093.81617965; Eh | |||
 | 13-Mar-2025 | butafenacil_CONF614_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2093.81567431; Eh | |||
 | 13-Mar-2025 | butafenacil_CONF607_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2093.81555420; Eh | |||
 | 13-Mar-2025 | butafenacil_CONF613_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2093.81539050; Eh | |||
 | 13-Mar-2025 | butafenacil_CONF616_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2093.81557055; Eh | |||
 | 13-Mar-2025 | butafenacil_CONF623_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2093.81608093; Eh | |||
 | 13-Mar-2025 | butafenacil_CONF595_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2093.81619879; Eh | |||
 | 13-Mar-2025 | butafenacil_CONF6_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2093.81440894; Eh | |||
 | 13-Mar-2025 | butafenacil_CONF522_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2093.81541268; Eh |
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