Search
Add filters:
Use filters to refine the search results.
Item hits:
| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 9-Feb-2023 | ethaboxam_CONF151_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1633.85198327; Eh | |||
 | 9-Feb-2023 | ethaboxam_CONF15_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1633.85112682; Eh | |||
 | 9-Feb-2023 | ethaboxam_CONF146_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1633.85159544; Eh | |||
 | 9-Feb-2023 | ethaboxam_CONF145_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1633.85121348; Eh | |||
 | 9-Feb-2023 | ethaboxam_CONF144_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1633.85134213; Eh | |||
 | 9-Feb-2023 | ethaboxam_CONF202_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1633.85085468; Eh | |||
 | 9-Feb-2023 | ethaboxam_CONF203_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1633.85079854; Eh | |||
 | 9-Feb-2023 | ethaboxam_CONF201_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1633.84943191; Eh |
Results 1581-1588 of 1588 (Search time: 0.002 seconds).
Discover
Calculation type