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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_CONF39_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.91967137; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF323_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.92001984; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF202_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.91932169; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF192_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.92000327; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF19_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.92008588; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF167_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.92231151; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF150_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.92026919; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF136_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.92177577; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF14_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.91989432; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF129_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.91867828; Eh |
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