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Collection's Items (Sorted by Submit Date in Descending order): 2341 to 2360 of 6276
| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 24-Mar-2025 | Permethrin_cis_CONF20_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42157749; Eh | |||
 | 24-Mar-2025 | Permethrin_cis_CONF201_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42568635; Eh | |||
 | 24-Mar-2025 | Permethrin_cis_CONF208_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42592296; Eh | |||
 | 24-Mar-2025 | Permethrin_cis_CONF209_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42593857; Eh | |||
 | 24-Mar-2025 | Permethrin_cis_CONF21_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42450293; Eh | |||
 | 24-Mar-2025 | Permethrin_cis_CONF214_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42563885; Eh | |||
 | 24-Mar-2025 | Permethrin_cis_CONF216_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42575153; Eh | |||
 | 24-Mar-2025 | Permethrin_cis_CONF22_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42442408; Eh | |||
 | 24-Mar-2025 | Permethrin_cis_CONF221_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42552446; Eh | |||
 | 24-Mar-2025 | Permethrin_cis_CONF23_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42437893; Eh | |||
 | 24-Mar-2025 | Permethrin_cis_CONF24_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42487699; Eh | |||
 | 24-Mar-2025 | Permethrin_cis_CONF245_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.41663272; Eh | |||
 | 24-Mar-2025 | Permethrin_cis_CONF248_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42148923; Eh | |||
 | 24-Mar-2025 | Permethrin_cis_CONF25_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42092572; Eh | |||
 | 24-Mar-2025 | Permethrin_cis_CONF27_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42497266; Eh | |||
 | 24-Mar-2025 | Permethrin_cis_CONF274_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42537755; Eh | |||
 | 24-Mar-2025 | Permethrin_cis_CONF279_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42571453; Eh | |||
 | 24-Mar-2025 | Permethrin_cis_CONF283_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42574659; Eh | |||
 | 24-Mar-2025 | Permethrin_cis_CONF286_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42577577; Eh | |||
 | 24-Mar-2025 | Permethrin_cis_CONF29_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42100463; Eh |
Collection's Items (Sorted by Submit Date in Descending order): 2341 to 2360 of 6276
