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Ground-state energy of the [4Fe-4S] iron–sulfur cluster
Find the lowest variational energy of a 54-electron, 36-orbital [4Fe-4S] cluster model; DMRG reaches about −327.24 Eh, the tracker's best entry −327.175.
| # | 路线 | Variational energy (Eh) ↓ | 对比基线 |
|---|---|---|---|
| — | 基线 · TrimCI_202511_6e7 on 4fe_4s_54e_36o (issue #58) | -327.175 | 条形从这里开始 |