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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 1-Dec-2022 | benomyl_CONF62_gas | Pla Terrada, Paula | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -989.18682620; Eh | |||
 | 1-Dec-2022 | benomyl_CONF6_gas | Pla Terrada, Paula | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -989.18615668; Eh | |||
 | 1-Dec-2022 | benomyl_CONF5_gas | Pla Terrada, Paula | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -989.18664591; Eh | |||
 | 1-Dec-2022 | benomyl_CONF31_gas | Pla Terrada, Paula | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -989.18625386; Eh | |||
 | 1-Dec-2022 | benomyl_CONF3_gas | Pla Terrada, Paula | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -989.18572842; Eh | |||
 | 1-Dec-2022 | benomyl_CONF28_gas | Pla Terrada, Paula | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -989.18673934; Eh | |||
 | 1-Dec-2022 | benomyl_CONF36_gas | Pla Terrada, Paula | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -989.18527300; Eh | |||
 | 1-Dec-2022 | benomyl_CONF37_gas | Pla Terrada, Paula | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -989.18535245; Eh | |||
 | 1-Dec-2022 | benomyl_CONF39_gas | Pla Terrada, Paula | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -989.18514189; Eh | |||
 | 1-Dec-2022 | benomyl_CONF33_gas | Pla Terrada, Paula | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -989.18609758; Eh |
Results 61-70 of 230 (Search time: 0.002 seconds).