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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
| 13-Mar-2025 | flumiclorac-pentyl_CONF360_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1805.21665701; Eh | ||||
| 13-Mar-2025 | flumiclorac-pentyl_CONF353_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1805.21685674; Eh | ||||
| 13-Mar-2025 | flumiclorac-pentyl_CONF36_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1805.21621402; Eh | ||||
| 13-Mar-2025 | flumiclorac-pentyl_CONF312_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1805.21658360; Eh | ||||
| 13-Mar-2025 | flumiclorac-pentyl_CONF310_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1805.21530708; Eh | ||||
| 13-Mar-2025 | flumiclorac-pentyl_CONF31_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1805.21485614; Eh | ||||
| 13-Mar-2025 | flumiclorac-pentyl_CONF313_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1805.21722178; Eh | ||||
| 13-Mar-2025 | flumiclorac-pentyl_CONF254_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1805.21550174; Eh | ||||
| 13-Mar-2025 | flumiclorac-pentyl_CONF260_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1805.21766828; Eh | ||||
| 13-Mar-2025 | flumiclorac-pentyl_CONF256_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1805.21456120; Eh |
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