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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_CONF38_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2093.81410565; Eh | |||
 | 13-Mar-2025 | butafenacil_CONF618_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2093.80596875; Eh | |||
 | 13-Mar-2025 | butafenacil_CONF623_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2093.80657912; Eh | |||
 | 13-Mar-2025 | butafenacil_CONF608_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2093.80576558; Eh | |||
 | 13-Mar-2025 | butafenacil_CONF625_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2093.80464477; Eh | |||
 | 13-Mar-2025 | butafenacil_CONF615_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2093.80709248; Eh | |||
 | 13-Mar-2025 | butafenacil_CONF613_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2093.80604177; Eh | |||
 | 13-Mar-2025 | butafenacil_CONF485_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2093.80359299; Eh | |||
 | 13-Mar-2025 | butafenacil_CONF438_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2093.80552533; Eh | |||
 | 13-Mar-2025 | butafenacil_CONF433_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2093.80550127; Eh |
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