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Collection's Items (Sorted by Submit Date in Descending order): 21 to 40 of 14192
| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 20-Mar-2025 | Phosphamidon_Z_CONF178_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1625.15468232; Eh | |||
 | 20-Mar-2025 | Phosphamidon_Z_CONF179_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1625.15478849; Eh | |||
 | 20-Mar-2025 | Phosphamidon_Z_CONF18_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1625.15728162; Eh | |||
 | 20-Mar-2025 | Phosphamidon_Z_CONF180_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1625.15461763; Eh | |||
 | 20-Mar-2025 | Phosphamidon_Z_CONF183_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1625.15467655; Eh | |||
 | 20-Mar-2025 | Phosphamidon_Z_CONF184_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1625.15464621; Eh | |||
 | 20-Mar-2025 | Phosphamidon_Z_CONF187_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1625.15406855; Eh | |||
 | 20-Mar-2025 | Phosphamidon_Z_CONF188_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1625.15422061; Eh | |||
 | 20-Mar-2025 | Phosphamidon_Z_CONF3_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1625.15576076; Eh | |||
 | 20-Mar-2025 | Phosphamidon_Z_CONF30_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1625.15640906; Eh | |||
 | 20-Mar-2025 | Phosphamidon_Z_CONF55_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1625.15447826; Eh | |||
 | 20-Mar-2025 | Phosphamidon_Z_CONF65_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1625.15334471; Eh | |||
 | 20-Mar-2025 | Phosphamidon_Z_CONF66_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1625.15497486; Eh | |||
 | 20-Mar-2025 | Phosphamidon_Z_CONF67_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1625.15498783; Eh | |||
 | 20-Mar-2025 | Phosphamidon_Z_CONF7_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1625.15529608; Eh | |||
 | 20-Mar-2025 | Phosphamidon_Z_CONF8_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1625.15528826; Eh | |||
 | 20-Mar-2025 | Phosphamidon_Z_CONF80_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1625.15509049; Eh | |||
 | 20-Mar-2025 | Phosphamidon_Z_CONF9_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1625.15659764; Eh | |||
 | 20-Mar-2025 | Phosphamidon_Z_CONF91_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1625.15541689; Eh | |||
 | 20-Mar-2025 | Phosphamidon_Z_CONF94_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1625.15400837; Eh |
Collection's Items (Sorted by Submit Date in Descending order): 21 to 40 of 14192
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Calculation type
- 12998 Single point
- 1194 Geometry optimization Minimum