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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
| 13-Mar-2025 | fomesafen_CONF10_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2296.48778889; Eh | ||||
| 13-Mar-2025 | fomesafen_CONF11_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2296.48759406; Eh | ||||
| 13-Mar-2025 | fomesafen_CONF12_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2296.48725331; Eh | ||||
| 13-Mar-2025 | fomesafen_CONF13_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2296.48725910; Eh | ||||
| 13-Mar-2025 | fluthiacet-methyl_CONF92_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2327.13516664; Eh | ||||
| 13-Mar-2025 | fluthiacet-methyl_CONF96_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2327.13629681; Eh | ||||
| 13-Mar-2025 | fluthiacet-methyl_CONF98_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2327.13519668; Eh | ||||
| 13-Mar-2025 | fluthiacet-methyl_CONF80_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2327.13561873; Eh | ||||
| 13-Mar-2025 | fluthiacet-methyl_CONF85_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2327.13575568; Eh | ||||
| 13-Mar-2025 | fluthiacet-methyl_CONF86_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2327.13576235; Eh |
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