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Collection's Items (Sorted by Submit Date in Descending order): 801 to 820 of 7773
| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 26-Mar-2025 | Cypermethrin_zeta_CONF349_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.65905983; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF350_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.66036853; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF351_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.65945480; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF352_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.65986561; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF353_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.66007302; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF354_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.65990455; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF355_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.66009936; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF356_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.65997431; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF358_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.66004189; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF359_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.65986089; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF36_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.65655702; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF38_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.66031227; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF4_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.65458359; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF40_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.65811431; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF41_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.65818758; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF42_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.66133033; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF43_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.65730426; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF45_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.66143824; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF48_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.66117731; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF49_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.66120911; Eh |
Collection's Items (Sorted by Submit Date in Descending order): 801 to 820 of 7773
