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