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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 24-Feb-2023 | ipflufenoquin_CONF30_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1238.49624013; Eh | |||
 | 24-Feb-2023 | ipflufenoquin_CONF39_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1238.49617979; Eh | |||
 | 24-Feb-2023 | ipflufenoquin_CONF38_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1238.49613964; Eh | |||
 | 24-Feb-2023 | ipflufenoquin_CONF4_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1238.49694153; Eh | |||
 | 24-Feb-2023 | ipflufenoquin_CONF40_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1238.49770384; Eh | |||
 | 24-Feb-2023 | ipflufenoquin_CONF43_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1238.49822381; Eh | |||
 | 24-Feb-2023 | ipflufenoquin_CONF44_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1238.49611816; Eh | |||
 | 24-Feb-2023 | ipflufenoquin_CONF61_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1238.50902747; Eh | |||
 | 24-Feb-2023 | ipflufenoquin_CONF67_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1238.51762430; Eh | |||
 | 24-Feb-2023 | ipflufenoquin_CONF65_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1238.51760449; Eh |
Results 21-30 of 151 (Search time: 0.001 seconds).