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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_CONF28_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.92740960; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF277_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.92764709; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF252_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.92742513; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF201_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.92702057; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF16_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.92701765; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF126_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.92846665; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF109_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.92593596; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF108_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.92806387; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF10_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.92735472; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF1_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.92447771; Eh |
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