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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_CONF48_gas | Pla Terrada, Paula | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1164.99658633; Eh | |||
 | 10-Feb-2022 | pefurazoate_CONF514_gas | Pla Terrada, Paula | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1164.99829915; Eh | |||
 | 10-Feb-2022 | pefurazoate_CONF515_gas | Pla Terrada, Paula | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1164.99516937; Eh | |||
 | 10-Feb-2022 | pefurazoate_CONF51_gas | Pla Terrada, Paula | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1164.99721803; Eh | |||
 | 10-Feb-2022 | pefurazoate_CONF57_gas | Pla Terrada, Paula | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1164.99785506; Eh | |||
 | 10-Feb-2022 | pefurazoate_CONF60_gas | Pla Terrada, Paula | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1164.99743838; Eh | |||
 | 10-Feb-2022 | pefurazoate_CONF6_gas | Pla Terrada, Paula | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1164.99750547; Eh | |||
 | 10-Feb-2022 | pefurazoate_CONF62_gas | Pla Terrada, Paula | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1164.99688379; Eh | |||
 | 10-Feb-2022 | pefurazoate_CONF657_gas | Pla Terrada, Paula | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1164.99837440; Eh | |||
 | 10-Feb-2022 | pefurazoate_CONF663_gas | Pla Terrada, Paula | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1164.99801851; Eh |
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