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Collection's Items (Sorted by Submit Date in Descending order): 1941 to 1960 of 6276
| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 24-Mar-2025 | Imiprothrin_RR_CONF76_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1071.54585535; Eh | |||
 | 24-Mar-2025 | Imiprothrin_RR_CONF97_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1071.54610591; Eh | |||
 | 24-Mar-2025 | Imiprothrin_RR_CONF102_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1071.53823687; Eh | |||
 | 24-Mar-2025 | Imiprothrin_RR_CONF103_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1071.53856207; Eh | |||
 | 24-Mar-2025 | Imiprothrin_RR_CONF105_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1071.53889997; Eh | |||
 | 24-Mar-2025 | Imiprothrin_RR_CONF112_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1071.53912097; Eh | |||
 | 24-Mar-2025 | Imiprothrin_RR_CONF114_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1071.54080822; Eh | |||
 | 24-Mar-2025 | Imiprothrin_RR_CONF117_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1071.54075604; Eh | |||
 | 24-Mar-2025 | Imiprothrin_RR_CONF118_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1071.53869874; Eh | |||
 | 24-Mar-2025 | Imiprothrin_RR_CONF12_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1071.53938394; Eh | |||
 | 24-Mar-2025 | Imiprothrin_RR_CONF120_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1071.54068643; Eh | |||
 | 24-Mar-2025 | Imiprothrin_RR_CONF122_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1071.54008695; Eh | |||
 | 24-Mar-2025 | Imiprothrin_RR_CONF123_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1071.53986755; Eh | |||
 | 24-Mar-2025 | Imiprothrin_RR_CONF126_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1071.53882811; Eh | |||
 | 24-Mar-2025 | Imiprothrin_RR_CONF128_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1071.54060950; Eh | |||
 | 24-Mar-2025 | Imiprothrin_RR_CONF134_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1071.54091607; Eh | |||
 | 24-Mar-2025 | Imiprothrin_RR_CONF138_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1071.54090618; Eh | |||
 | 24-Mar-2025 | Imiprothrin_RR_CONF139_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1071.54099099; Eh | |||
 | 24-Mar-2025 | Imiprothrin_RR_CONF14_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1071.53922815; Eh | |||
 | 24-Mar-2025 | Imiprothrin_RR_CONF141_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1071.54058444; Eh |
Collection's Items (Sorted by Submit Date in Descending order): 1941 to 1960 of 6276
