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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 10-Sep-2022 | chlorsulfuron_CONF1_water | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1897.73661700; Eh | |||
 | 10-Sep-2022 | chlorsulfuron_CONF9_octanol | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1897.73987177; Eh | |||
 | 10-Sep-2022 | chlorsulfuron_CONF8_octanol | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1897.73941938; Eh | |||
 | 10-Sep-2022 | flazasulfuron_CONF128_gas | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1850.41085071; Eh | |||
 | 10-Sep-2022 | ethoxisulfuron_CONF1356_gas | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1726.36544643; Eh | |||
 | 10-Sep-2022 | ethoxisulfuron_CONF1420_gas | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1726.36491300; Eh | |||
 | 10-Sep-2022 | ethoxisulfuron_CONF1360_gas | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1726.36554344; Eh | |||
 | 10-Sep-2022 | flazasulfuron_CONF131_gas | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1850.41189031; Eh | |||
 | 10-Sep-2022 | flazasulfuron_CONF132_gas | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1850.41191504; Eh | |||
 | 10-Sep-2022 | ethoxisulfuron_CONF1543_gas | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1726.36711077; Eh |
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- 4871 Orca