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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 9-Feb-2023 | ethaboxam_CONF249_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1633.85137605; Eh | |||
 | 9-Feb-2023 | ethaboxam_CONF254_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1633.85037045; Eh | |||
 | 25-Apr-2023 | butafenacil_CONF289_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2093.81478170; Eh | |||
 | 17-Jan-2023 | prosulfocarb_CONF195_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1074.41186247; Eh | |||
 | 25-May-2023 | indaziflam_CONF32_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -995.53350871; Eh | |||
 | 15-Dec-2022 | spiroxamine_CONF13_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -912.29512318; Eh | |||
 | 9-Feb-2023 | ethaboxam_CONF219_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1633.85050852; Eh | |||
 | 9-Feb-2023 | ethaboxam_CONF233_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1633.85023945; Eh | |||
 | 25-Apr-2023 | butafenacil_CONF28_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2093.81602739; Eh | |||
 | 15-Dec-2022 | spiroxamine_CONF120_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -912.29546719; Eh |
Results 51031-51040 of 78833 (Search time: 0.04 seconds).