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Collection's Items (Sorted by Submit Date in Descending order): 701 to 720 of 7773
| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 26-Mar-2025 | Cypermethrin_zeta_CONF10_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.65643298; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF100_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.65660592; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF102_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.66104245; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF104_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.65944308; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF11_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.65624028; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF110_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.65447422; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF113_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.65580416; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF118_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.66036896; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF12_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.65674390; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF121_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.66033508; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF122_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.66050912; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF123_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.65946759; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF124_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.66006066; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF129_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.65659206; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF130_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.66156018; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF131_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.66191215; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF134_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.66196608; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF135_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.66223101; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF136_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.66179443; Eh | |||
 | 26-Mar-2025 | Cypermethrin_zeta_CONF138_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2050.66198068; Eh |
Collection's Items (Sorted by Submit Date in Descending order): 701 to 720 of 7773
