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Item hits:
| Preview | Title | Author(s) | Program | Method(s) | Basis Set | Energy | Solv. | Vibr. |
|---|---|---|---|---|---|---|---|---|
 | IP_files | Mukherjee, Madhubani | Orca; 4.0; CURRENT | RHF; HFFRAGMENTINTERACTION | - | -18158.43963682; Eh | ||
 | IP_files | Mukherjee, Madhubani | Orca; 4.0; CURRENT | RHF; HFFRAGMENTINTERACTION | - | -18158.43963682; Eh | ||
 | Final_3_layer_IP_files | Mukherjee, Madhubani | Orca; 4.0; CURRENT | RHF; HFFRAGMENTINTERACTION | - | -18158.43963682; Eh | ||
 | 3-_layer_IP | Mukherjee, Madhubani | Orca; 4.0; CURRENT | RHF; HFFRAGMENTINTERACTION | - | -18158.43963682; Eh |
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