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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 10-Oct-2022 | terbacil_CONF3_gas | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1071.04938419; Eh | |||
 | 10-Oct-2022 | terbacil_CONF4_octanol | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1071.06912181; Eh | |||
 | 10-Oct-2022 | terbacil_CONF6_water | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1071.06289040; Eh | |||
 | 10-Oct-2022 | propanil_CONF5_water | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1398.85254782; Eh | |||
 | 10-Oct-2022 | phenmedipham_CONF32_octanol | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1029.91001140; Eh | |||
 | 10-Oct-2022 | phenmedipham_CONF7_gas | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1029.88841079; Eh | |||
 | 10-Oct-2022 | monuron_CONF2_octanol | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -994.60372281; Eh | |||
 | 10-Oct-2022 | monuron_CONF1_octanol | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -994.60879942; Eh | |||
 | 10-Oct-2022 | metribuzin_CONF1_water | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1005.74034500; Eh | |||
 | 10-Oct-2022 | metribuzin_CONF2_water | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1005.74041718; Eh |
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- 365 Single point