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Collection's Items (Sorted by Submit Date in Descending order): 2441 to 2460 of 6276
| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 24-Mar-2025 | Permethrin_trans_CONF1_gas | Pulgar Rubio, Antonio | Orca; 5.0.3; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42149259; Eh | |||
 | 24-Mar-2025 | Permethrin_trans_CONF10_gas | Pulgar Rubio, Antonio | Orca; 5.0.3; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42603297; Eh | |||
 | 24-Mar-2025 | Permethrin_trans_CONF101_gas | Pulgar Rubio, Antonio | Orca; 5.0.3; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42552113; Eh | |||
 | 24-Mar-2025 | Permethrin_trans_CONF102_gas | Pulgar Rubio, Antonio | Orca; 5.0.3; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42318304; Eh | |||
 | 24-Mar-2025 | Permethrin_trans_CONF108_gas | Pulgar Rubio, Antonio | Orca; 5.0.3; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42659312; Eh | |||
 | 24-Mar-2025 | Permethrin_trans_CONF112_gas | Pulgar Rubio, Antonio | Orca; 5.0.3; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42672640; Eh | |||
 | 24-Mar-2025 | Permethrin_trans_CONF113_gas | Pulgar Rubio, Antonio | Orca; 5.0.3; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42693019; Eh | |||
 | 24-Mar-2025 | Permethrin_trans_CONF114_gas | Pulgar Rubio, Antonio | Orca; 5.0.3; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42678889; Eh | |||
 | 24-Mar-2025 | Permethrin_trans_CONF115_gas | Pulgar Rubio, Antonio | Orca; 5.0.3; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42570286; Eh | |||
 | 24-Mar-2025 | Permethrin_trans_CONF117_gas | Pulgar Rubio, Antonio | Orca; 5.0.3; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42678787; Eh | |||
 | 24-Mar-2025 | Permethrin_trans_CONF12_gas | Pulgar Rubio, Antonio | Orca; 5.0.3; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42627413; Eh | |||
 | 24-Mar-2025 | Permethrin_trans_CONF120_gas | Pulgar Rubio, Antonio | Orca; 5.0.3; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42678256; Eh | |||
 | 24-Mar-2025 | Permethrin_trans_CONF121_gas | Pulgar Rubio, Antonio | Orca; 5.0.3; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42559267; Eh | |||
 | 24-Mar-2025 | Permethrin_trans_CONF124_gas | Pulgar Rubio, Antonio | Orca; 5.0.3; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42683038; Eh | |||
 | 24-Mar-2025 | Permethrin_trans_CONF126_gas | Pulgar Rubio, Antonio | Orca; 5.0.3; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42670942; Eh | |||
 | 24-Mar-2025 | Permethrin_trans_CONF127_gas | Pulgar Rubio, Antonio | Orca; 5.0.3; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42677859; Eh | |||
 | 24-Mar-2025 | Permethrin_trans_CONF128_gas | Pulgar Rubio, Antonio | Orca; 5.0.3; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42658225; Eh | |||
 | 24-Mar-2025 | Permethrin_trans_CONF129_gas | Pulgar Rubio, Antonio | Orca; 5.0.3; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42677686; Eh | |||
 | 24-Mar-2025 | Permethrin_trans_CONF13_gas | Pulgar Rubio, Antonio | Orca; 5.0.3; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42621580; Eh | |||
 | 24-Mar-2025 | Permethrin_trans_CONF130_gas | Pulgar Rubio, Antonio | Orca; 5.0.3; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42651750; Eh |
Collection's Items (Sorted by Submit Date in Descending order): 2441 to 2460 of 6276
