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Collection's Items (Sorted by Submit Date in Descending order): 161 to 180 of 6276
| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 24-Mar-2025 | Cyphenothrin_RR_CONF166_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.09311966; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF170_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.09086431; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF171_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.09044386; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF177_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.09212878; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF178_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.09206020; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF182_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.09175496; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF185_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.09221233; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF186_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.09221365; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF187_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.09169488; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF188_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.09309515; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF19_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.09261137; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF191_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.09216546; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF193_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.09320206; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF194_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.09330705; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF195_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.09207843; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF196_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.09251790; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF199_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.09298105; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF2_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.09040500; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF206_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.09338095; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RR_CONF212_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1210.09167857; Eh |
Collection's Items (Sorted by Submit Date in Descending order): 161 to 180 of 6276
