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Collection's Items (Sorted by Submit Date in Descending order): 81 to 100 of 6276
| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 24-Mar-2025 | Cyphenothrin_RR_CONF698_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.10622763; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF699_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.10631693; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF702_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.10655957; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF703_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.10654834; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF714_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.10467640; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF715_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.10661912; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF72_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.10437292; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF722_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.10683576; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF725_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.10572475; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF73_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.10476610; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF732_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.10719208; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF755_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.10557160; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF770_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.10675407; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF784_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.10590166; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF787_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.10660091; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF79_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.10424347; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF792_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.10472855; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF799_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.10311614; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF8_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.10221167; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF800_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.10333245; Eh |
Collection's Items (Sorted by Submit Date in Descending order): 81 to 100 of 6276
