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. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 13-Mar-2025 | carfentrazone-ethyl_CONF68_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.11520948; Eh | |||
 | 13-Mar-2025 | carfentrazone-ethyl_CONF61_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.11896880; Eh | |||
 | 13-Mar-2025 | carfentrazone-ethyl_CONF46_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.11829227; Eh | |||
 | 13-Mar-2025 | carfentrazone-ethyl_CONF55_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.11871528; Eh | |||
 | 13-Mar-2025 | carfentrazone-ethyl_CONF6_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.11725911; Eh | |||
 | 13-Mar-2025 | carfentrazone-ethyl_CONF56_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.11615794; Eh | |||
 | 13-Mar-2025 | carfentrazone-ethyl_CONF300_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.11510778; Eh | |||
 | 13-Mar-2025 | carfentrazone-ethyl_CONF308_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.11714284; Eh | |||
 | 13-Mar-2025 | carfentrazone-ethyl_CONF344_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.11795967; Eh | |||
 | 13-Mar-2025 | carfentrazone-ethyl_CONF310_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2190.11800455; Eh |
Results 1791-1800 of 3134 (Search time: 0.002 seconds).
Discover
Calculation type