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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_CONF302_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.92099669; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF244_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.91970249; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF207_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.91930139; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF73_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.92087889; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF65_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.92030273; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF64_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.91989541; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF56_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.92070734; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF58_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.92038915; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF6_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.91816909; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF53_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.91982300; Eh |
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