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Collection's Items (Sorted by Submit Date in Descending order): 721 to 740 of 7773
| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 26-Mar-2025 | Cypermethrin_zeta_CONF139_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.66174652; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF142_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.66110452; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF144_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.66116130; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF149_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.65730956; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF150_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.65701637; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF151_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.66110149; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF152_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.66147430; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF153_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.66087964; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF156_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.66104127; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF157_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.66130084; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF158_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.65892117; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF159_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.65847203; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF162_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.65796008; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF163_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.65768428; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF165_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.65867852; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF166_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.65739315; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF167_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.65757219; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF17_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.65791945; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF176_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.65757434; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF179_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.66134566; Eh |
Collection's Items (Sorted by Submit Date in Descending order): 721 to 740 of 7773
