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Collection's Items (Sorted by Submit Date in Descending order): 2541 to 2560 of 6276
| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 24-Mar-2025 | Permethrin_trans_CONF47_gas | Pulgar Rubio, Antonio | Orca; 5.0.3; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42317128; Eh | |||
 | 24-Mar-2025 | Permethrin_trans_CONF473_gas | Pulgar Rubio, Antonio | Orca; 5.0.3; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42662833; Eh | |||
 | 24-Mar-2025 | Permethrin_trans_CONF48_gas | Pulgar Rubio, Antonio | Orca; 5.0.3; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42648717; Eh | |||
 | 24-Mar-2025 | Permethrin_trans_CONF485_gas | Pulgar Rubio, Antonio | Orca; 5.0.3; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42663110; Eh | |||
 | 24-Mar-2025 | Permethrin_trans_CONF49_gas | Pulgar Rubio, Antonio | Orca; 5.0.3; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42634633; Eh | |||
 | 24-Mar-2025 | Permethrin_trans_CONF494_gas | Pulgar Rubio, Antonio | Orca; 5.0.3; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42676972; Eh | |||
 | 24-Mar-2025 | Permethrin_trans_CONF498_gas | Pulgar Rubio, Antonio | Orca; 5.0.3; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42498937; Eh | |||
 | 24-Mar-2025 | Permethrin_trans_CONF5_gas | Pulgar Rubio, Antonio | Orca; 5.0.3; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42566602; Eh | |||
 | 24-Mar-2025 | Permethrin_trans_CONF509_gas | Pulgar Rubio, Antonio | Orca; 5.0.3; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42499610; Eh | |||
 | 24-Mar-2025 | Permethrin_trans_CONF51_gas | Pulgar Rubio, Antonio | Orca; 5.0.3; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42434111; Eh | |||
 | 24-Mar-2025 | Permethrin_trans_CONF513_gas | Pulgar Rubio, Antonio | Orca; 5.0.3; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42140970; Eh | |||
 | 24-Mar-2025 | Permethrin_trans_CONF518_gas | Pulgar Rubio, Antonio | Orca; 5.0.3; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42448693; Eh | |||
 | 24-Mar-2025 | Permethrin_trans_CONF519_gas | Pulgar Rubio, Antonio | Orca; 5.0.3; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42701110; Eh | |||
 | 24-Mar-2025 | Permethrin_trans_CONF52_gas | Pulgar Rubio, Antonio | Orca; 5.0.3; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42626792; Eh | |||
 | 24-Mar-2025 | Permethrin_trans_CONF522_gas | Pulgar Rubio, Antonio | Orca; 5.0.3; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42691614; Eh | |||
 | 24-Mar-2025 | Permethrin_trans_CONF53_gas | Pulgar Rubio, Antonio | Orca; 5.0.3; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42631158; Eh | |||
 | 24-Mar-2025 | Permethrin_trans_CONF54_gas | Pulgar Rubio, Antonio | Orca; 5.0.3; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42636590; Eh | |||
 | 24-Mar-2025 | Permethrin_trans_CONF55_gas | Pulgar Rubio, Antonio | Orca; 5.0.3; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42229023; Eh | |||
 | 24-Mar-2025 | Permethrin_trans_CONF56_gas | Pulgar Rubio, Antonio | Orca; 5.0.3; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42631088; Eh | |||
 | 24-Mar-2025 | Permethrin_trans_CONF57_gas | Pulgar Rubio, Antonio | Orca; 5.0.3; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1958.42622433; Eh |
Collection's Items (Sorted by Submit Date in Descending order): 2541 to 2560 of 6276
