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Collection's Items (Sorted by Submit Date in Descending order): 221 to 240 of 6276
| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 24-Mar-2025 | Cyphenothrin_RR_CONF59_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.09345605; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF590_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.09118584; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF6_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.09170035; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF60_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.09291815; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF600_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.09104443; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF649_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.09245539; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF656_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.09093621; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF66_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.09139908; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF689_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.09300364; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF69_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.09366545; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF697_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.09289735; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF698_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.09278208; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF7_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.09299240; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF702_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.09314869; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF73_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.09117589; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF76_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.09186064; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF787_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.09300560; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF79_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.09165954; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF8_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.09054048; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF800_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.09028177; Eh |
Collection's Items (Sorted by Submit Date in Descending order): 221 to 240 of 6276
