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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_CONF245_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.11543664; Eh | |||
 | 13-Mar-2025 | carfentrazone-ethyl_CONF246_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.11957272; Eh | |||
 | 13-Mar-2025 | carfentrazone-ethyl_CONF169_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.11861332; Eh | |||
 | 13-Mar-2025 | carfentrazone-ethyl_CONF168_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.11815807; Eh | |||
 | 13-Mar-2025 | carfentrazone-ethyl_CONF117_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.11579150; Eh | |||
 | 13-Mar-2025 | carfentrazone-ethyl_CONF114_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.11794336; Eh | |||
 | 13-Mar-2025 | carfentrazone-ethyl_CONF115_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.11794137; Eh | |||
 | 13-Mar-2025 | carfentrazone-ethyl_CONF121_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.11569294; Eh | |||
 | 13-Mar-2025 | carfentrazone-ethyl_CONF130_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.11716918; Eh | |||
 | 13-Mar-2025 | carfentrazone-ethyl_CONF10_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.11809753; Eh |
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