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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_CONF200_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1805.18568206; Eh | ||||
| 13-Mar-2025 | flumiclorac-pentyl_CONF2_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1805.18499612; Eh | ||||
| 13-Mar-2025 | flumiclorac-pentyl_CONF177_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1805.18769753; Eh | ||||
| 13-Mar-2025 | flumiclorac-pentyl_CONF18_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1805.18547262; Eh | ||||
| 13-Mar-2025 | flumiclorac-pentyl_CONF179_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1805.18699184; Eh | ||||
| 13-Mar-2025 | flumiclorac-pentyl_CONF162_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1805.18441069; Eh | ||||
| 13-Mar-2025 | flumiclorac-pentyl_CONF163_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1805.18469540; Eh | ||||
| 13-Mar-2025 | flumiclorac-pentyl_CONF161_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1805.18424830; Eh | ||||
| 13-Mar-2025 | flumiclorac-pentyl_CONF167_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1805.18477995; Eh | ||||
| 13-Mar-2025 | flumiclorac-pentyl_CONF15_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1805.18508358; Eh |
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