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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 13-Mar-2025 | saflufenacil_CONF79_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2511.22574193; Eh | |||
 | 13-Mar-2025 | saflufenacil_CONF73_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2511.22652067; Eh | |||
 | 13-Mar-2025 | saflufenacil_CONF188_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2511.22694863; Eh | |||
 | 13-Mar-2025 | saflufenacil_CONF86_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2511.22537322; Eh | |||
 | 13-Mar-2025 | saflufenacil_CONF208_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2511.22601448; Eh | |||
 | 13-Mar-2025 | sulfentrazone_CONF15_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2388.34407317; Eh | |||
 | 13-Mar-2025 | sulfentrazone_CONF2_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2388.34425717; Eh | |||
 | 13-Mar-2025 | saflufenacil_CONF71_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2511.22719470; Eh | |||
 | 13-Mar-2025 | saflufenacil_CONF190_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2511.22617336; Eh | |||
 | 13-Mar-2025 | saflufenacil_CONF186_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2511.22650371; Eh |
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