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 | pyraflufen-ethyl_CONF64_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.90410116; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF63_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.90319368; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF62_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.90226708; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF56_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.90349407; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF95_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.90225164; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF92_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.90161040; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF91_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.90368474; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF86_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.90477726; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF81_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.90487162; Eh | |||
 | 13-Mar-2025 | pyraflufen-ethyl_CONF78_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2209.90466470; Eh |
Results 521-530 of 3134 (Search time: 0.002 seconds).
Discover
Calculation type