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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
| 13-Mar-2025 | epyrifenacil_CONF10_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2285.29287500; Eh | ||||
| 13-Mar-2025 | cinidon-ethyl_CONF9_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2010.48809721; Eh | ||||
| 13-Mar-2025 | cinidon-ethyl_CONF29_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2010.48737311; Eh | ||||
| 13-Mar-2025 | cinidon-ethyl_CONF27_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2010.48793867; Eh | ||||
| 13-Mar-2025 | cinidon-ethyl_CONF26_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2010.48638563; Eh | ||||
| 13-Mar-2025 | cinidon-ethyl_CONF28_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2010.48766988; Eh | ||||
| 13-Mar-2025 | cinidon-ethyl_CONF33_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2010.45792578; Eh | ||||
| 13-Mar-2025 | cinidon-ethyl_CONF9_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2010.46161481; Eh | ||||
| 13-Mar-2025 | cinidon-ethyl_CONF38_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2010.45859089; Eh | ||||
| 13-Mar-2025 | cinidon-ethyl_CONF6_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2010.46060935; Eh |
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