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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 10-Sep-2022 | ethametsulfuron_CONF466_water | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1760.73358265; Eh | |||
 | 10-Sep-2022 | ethametsulfuron_CONF467_water | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1760.72967576; Eh | |||
 | 10-Sep-2022 | chlorimuron_methyl_CONF30_water | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -2109.58466691; Eh | |||
 | 10-Sep-2022 | chlorimuron_methyl_CONF15_water | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -2109.58482325; Eh | |||
 | 10-Sep-2022 | chlorimuron_methyl_CONF77_octanol | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -2109.58722454; Eh | |||
 | 10-Sep-2022 | chlorimuron_methyl_CONF75_octanol | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -2109.58601700; Eh | |||
 | 10-Sep-2022 | ethoxisulfuron_CONF1303_water | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1726.38784513; Eh | |||
 | 10-Sep-2022 | chlorimuron_methyl_CONF58_water | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -2109.58130745; Eh | |||
 | 10-Sep-2022 | chlorimuron_methyl_CONF54_water | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -2109.58060708; Eh | |||
 | 10-Sep-2022 | chlorimuron_methyl_CONF27_water | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -2109.58284899; Eh |
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- 4871 Orca