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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_CONF168_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.90421962; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF127_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.90402392; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF126_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.90361026; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF311_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.90518019; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF252_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.90411977; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF21_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.90289964; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF177_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.90382664; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF175_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.90439385; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF1_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.90143836; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF294_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.90480586; Eh |
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