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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 10-Feb-2022 | pefurazoate_CONF239_gas | Pla Terrada, Paula | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1164.99669952; Eh | |||
 | 10-Feb-2022 | pefurazoate_CONF275_gas | Pla Terrada, Paula | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1164.99876447; Eh | |||
 | 10-Feb-2022 | pefurazoate_CONF288_gas | Pla Terrada, Paula | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1164.99593316; Eh | |||
 | 10-Feb-2022 | pefurazoate_CONF289_gas | Pla Terrada, Paula | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1164.99626780; Eh | |||
 | 10-Feb-2022 | pefurazoate_CONF350_gas | Pla Terrada, Paula | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1164.99605577; Eh | |||
 | 10-Feb-2022 | pefurazoate_CONF353_gas | Pla Terrada, Paula | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1164.99723242; Eh | |||
 | 10-Feb-2022 | pefurazoate_CONF351_gas | Pla Terrada, Paula | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1164.99282334; Eh | |||
 | 10-Feb-2022 | pefurazoate_CONF35_gas | Pla Terrada, Paula | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1164.99783220; Eh | |||
 | 10-Feb-2022 | pefurazoate_CONF356_gas | Pla Terrada, Paula | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1164.99764324; Eh | |||
 | 10-Feb-2022 | pefurazoate_CONF401_gas | Pla Terrada, Paula | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1164.99837843; Eh |
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