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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_CONF177_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.92703581; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF167_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.92952438; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF158_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.92743549; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF150_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.92779729; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF151_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.92778349; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF308_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.92730383; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF305_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.92842216; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF300_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.92779194; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF30_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.92892131; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF279_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.92771069; Eh |
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