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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 21-Dec-2021 | propiconazole_RR_CONF25_gas | Pla Terrada, Paula | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1817.01707344; Eh | |||
 | 21-Dec-2021 | propiconazole_RR_CONF27_gas | Pla Terrada, Paula | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1817.01523880; Eh | |||
 | 21-Dec-2021 | propiconazole_RR_CONF30_gas | Pla Terrada, Paula | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1817.01584972; Eh | |||
 | 21-Dec-2021 | propiconazole_RR_CONF28_gas | Pla Terrada, Paula | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1817.01525499; Eh | |||
 | 21-Dec-2021 | propiconazole_RR_CONF3_gas | Pla Terrada, Paula | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1817.01757231; Eh | |||
 | 21-Dec-2021 | propiconazole_RR_CONF31_gas | Pla Terrada, Paula | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1817.01550339; Eh | |||
 | 21-Dec-2021 | propiconazole_RR_CONF33_gas | Pla Terrada, Paula | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1817.01561891; Eh | |||
 | 21-Dec-2021 | propiconazole_RR_CONF36_gas | Pla Terrada, Paula | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1817.01580992; Eh | |||
 | 21-Dec-2021 | propiconazole_RR_CONF39_gas | Pla Terrada, Paula | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1817.01864851; Eh |
Results 5171-5179 of 5179 (Search time: 0.004 seconds).