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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_CONF139_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1805.18722807; Eh | ||||
| 13-Mar-2025 | flumiclorac-pentyl_CONF140_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1805.18465270; Eh | ||||
| 13-Mar-2025 | flumiclorac-pentyl_CONF141_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1805.18717548; Eh | ||||
| 13-Mar-2025 | flumiclorac-pentyl_CONF136_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1805.18575186; Eh | ||||
| 13-Mar-2025 | flumiclorac-pentyl_CONF128_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1805.18504066; Eh | ||||
| 13-Mar-2025 | flumiclorac-pentyl_CONF129_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1805.18600542; Eh | ||||
| 13-Mar-2025 | flumiclorac-pentyl_CONF127_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1805.18736723; Eh | ||||
| 13-Mar-2025 | flumiclorac-pentyl_CONF130_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1805.18591325; Eh | ||||
| 13-Mar-2025 | flumiclorac-pentyl_CONF113_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1805.18367351; Eh | ||||
| 13-Mar-2025 | flumiclorac-pentyl_CONF11_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1805.18535393; Eh |
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