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Collection's Items (Sorted by Submit Date in Descending order): 2301 to 2320 of 6276
| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 24-Mar-2025 | Permethrin_cis_CONF13_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42495475; Eh | |||
 | 24-Mar-2025 | Permethrin_cis_CONF130_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.41987775; Eh | |||
 | 24-Mar-2025 | Permethrin_cis_CONF132_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42143795; Eh | |||
 | 24-Mar-2025 | Permethrin_cis_CONF134_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.41718654; Eh | |||
 | 24-Mar-2025 | Permethrin_cis_CONF135_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42169249; Eh | |||
 | 24-Mar-2025 | Permethrin_cis_CONF136_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42549540; Eh | |||
 | 24-Mar-2025 | Permethrin_cis_CONF137_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42139509; Eh | |||
 | 24-Mar-2025 | Permethrin_cis_CONF140_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42552994; Eh | |||
 | 24-Mar-2025 | Permethrin_cis_CONF141_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42151694; Eh | |||
 | 24-Mar-2025 | Permethrin_cis_CONF142_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42549188; Eh | |||
 | 24-Mar-2025 | Permethrin_cis_CONF143_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42488593; Eh | |||
 | 24-Mar-2025 | Permethrin_cis_CONF144_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42507724; Eh | |||
 | 24-Mar-2025 | Permethrin_cis_CONF148_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.41767666; Eh | |||
 | 24-Mar-2025 | Permethrin_cis_CONF149_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42518822; Eh | |||
 | 24-Mar-2025 | Permethrin_cis_CONF15_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42486394; Eh | |||
 | 24-Mar-2025 | Permethrin_cis_CONF152_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42561572; Eh | |||
 | 24-Mar-2025 | Permethrin_cis_CONF155_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42577280; Eh | |||
 | 24-Mar-2025 | Permethrin_cis_CONF156_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42513634; Eh | |||
 | 24-Mar-2025 | Permethrin_cis_CONF157_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42581750; Eh | |||
 | 24-Mar-2025 | Permethrin_cis_CONF159_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42498250; Eh |
Collection's Items (Sorted by Submit Date in Descending order): 2301 to 2320 of 6276
