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Collection's Items (Sorted by Submit Date in Descending order): 741 to 760 of 7773
| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 26-Mar-2025 | Cypermethrin_zeta_CONF18_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.65734417; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF182_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.65951999; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF184_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.66075282; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF186_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.65958341; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF189_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.66198899; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF19_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.65862367; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF193_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.65640824; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF195_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.66204494; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF197_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.65625435; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF20_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.65858625; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF201_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.66140627; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF204_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.66196267; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF207_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.66141914; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF208_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.66156967; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF21_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.65888026; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF22_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.65903913; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF224_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.66175094; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF231_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.66186851; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF234_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.66090748; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF238_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.65956208; Eh |
Collection's Items (Sorted by Submit Date in Descending order): 741 to 760 of 7773
