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Collection's Items (Sorted by Submit Date in Descending order): 41 to 60 of 6276
| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 24-Mar-2025 | Cyphenothrin_RR_CONF491_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.10366352; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF497_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.10603970; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF50_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.10646933; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF509_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.10732229; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF514_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.10387118; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF515_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.10483100; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF519_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.10485888; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF525_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.10483647; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF53_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.10548010; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF535_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.10475414; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF547_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.10768141; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF550_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.10680961; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF559_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.10612621; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF56_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.10527827; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF576_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.10522304; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF583_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.10511259; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF587_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.10679317; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF596_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.10582635; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF601_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.10564824; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF604_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.10393177; Eh |
Collection's Items (Sorted by Submit Date in Descending order): 41 to 60 of 6276
