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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 25-May-2023 | tetflupyrolimet_CONF12_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1393.22781289; Eh | |||
 | 25-May-2023 | tetflupyrolimet_CONF13_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1393.22767756; Eh | |||
 | 25-May-2023 | tetflupyrolimet_CONF15_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1393.22752112; Eh | |||
 | 25-May-2023 | tetflupyrolimet_CONF24_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1393.22817040; Eh | |||
 | 25-May-2023 | tetflupyrolimet_CONF18_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1393.22766850; Eh | |||
 | 25-May-2023 | tetflupyrolimet_CONF23_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1393.22817201; Eh | |||
 | 25-May-2023 | tetflupyrolimet_CONF17_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1393.22764238; Eh | |||
 | 25-May-2023 | tetflupyrolimet_CONF16_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1393.22750835; Eh | |||
 | 25-May-2023 | tetflupyrolimet_CONF27_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1393.22740131; Eh | |||
 | 25-May-2023 | tetflupyrolimet_CONF26_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1393.22703873; Eh |
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