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. |
---|---|---|---|---|---|---|---|---|---|---|---|
25-Apr-2023 | flumiclorac-pentyl_CONF35_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1805.21533537; Eh | ||||
25-Apr-2023 | flumiclorac-pentyl_CONF348_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1805.21679685; Eh | ||||
25-Apr-2023 | flumiclorac-pentyl_CONF343_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1805.21530351; Eh | ||||
25-Apr-2023 | flumiclorac-pentyl_CONF340_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1805.21611399; Eh | ||||
25-Apr-2023 | flumiclorac-pentyl_CONF346_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1805.21709853; Eh | ||||
25-Apr-2023 | flumiclorac-pentyl_CONF349_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1805.21645472; Eh | ||||
25-Apr-2023 | flumiclorac-pentyl_CONF347_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1805.21625604; Eh | ||||
25-Apr-2023 | flumiclorac-pentyl_CONF350_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1805.21643450; Eh | ||||
25-Apr-2023 | flumiclorac-pentyl_CONF332_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1805.21689026; Eh | ||||
25-Apr-2023 | flumiclorac-pentyl_CONF327_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1805.21685919; Eh |
Results 1-10 of 5330 (Search time: 0.002 seconds).
Discover
Calculation type
- 5330 Single point