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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 13-Mar-2025 | pyraflufen-ethyl_CONF344_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.92022675; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF338_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.92068567; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF340_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.92044344; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF334_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.92045402; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF332_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.92071135; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF32_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.92180802; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF318_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.91946974; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF311_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.92048595; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF31_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.92132258; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF306_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.92063487; Eh |
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