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Collection's Items (Sorted by Submit Date in Descending order): 1921 to 1940 of 6276
| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 24-Mar-2025 | Imiprothrin_RR_CONF321_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1071.54772530; Eh | |||
 | 24-Mar-2025 | Imiprothrin_RR_CONF322_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1071.54645528; Eh | |||
 | 24-Mar-2025 | Imiprothrin_RR_CONF323_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1071.54722170; Eh | |||
 | 24-Mar-2025 | Imiprothrin_RR_CONF324_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1071.54632038; Eh | |||
 | 24-Mar-2025 | Imiprothrin_RR_CONF325_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1071.54603843; Eh | |||
 | 24-Mar-2025 | Imiprothrin_RR_CONF38_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1071.54645291; Eh | |||
 | 24-Mar-2025 | Imiprothrin_RR_CONF42_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1071.54512450; Eh | |||
 | 24-Mar-2025 | Imiprothrin_RR_CONF43_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1071.54515672; Eh | |||
 | 24-Mar-2025 | Imiprothrin_RR_CONF44_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1071.54508482; Eh | |||
 | 24-Mar-2025 | Imiprothrin_RR_CONF45_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1071.54513642; Eh | |||
 | 24-Mar-2025 | Imiprothrin_RR_CONF47_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1071.54650239; Eh | |||
 | 24-Mar-2025 | Imiprothrin_RR_CONF50_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1071.54649740; Eh | |||
 | 24-Mar-2025 | Imiprothrin_RR_CONF56_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1071.54508843; Eh | |||
 | 24-Mar-2025 | Imiprothrin_RR_CONF59_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1071.54480742; Eh | |||
 | 24-Mar-2025 | Imiprothrin_RR_CONF60_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1071.54486357; Eh | |||
 | 24-Mar-2025 | Imiprothrin_RR_CONF63_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1071.54585833; Eh | |||
 | 24-Mar-2025 | Imiprothrin_RR_CONF66_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1071.54576415; Eh | |||
 | 24-Mar-2025 | Imiprothrin_RR_CONF69_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1071.54618974; Eh | |||
 | 24-Mar-2025 | Imiprothrin_RR_CONF71_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1071.54610644; Eh | |||
 | 24-Mar-2025 | Imiprothrin_RR_CONF75_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1071.54490946; Eh |
Collection's Items (Sorted by Submit Date in Descending order): 1921 to 1940 of 6276
