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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_CONF333_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.92067691; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF298_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.92031626; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF300_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.91975857; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF286_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.92075102; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF77_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.92064121; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF62_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.92112388; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF411_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.92044868; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF42_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.92056647; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF405_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.92157128; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF403_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.92147893; Eh |
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