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Item hits:
| Preview | Title | Author(s) | Program | Method(s) | Basis Set | Energy | Solv. | Vibr. |
|---|---|---|---|---|---|---|---|---|
 | c4_Fe_O1 | Chuong Nguyën, Huu | QuantumEspresso; 6.2; 13949:13950 | PBE | Ultrasoft | -194128.485837; eV | ||
 | c4_Ni_O1 | Chuong Nguyën, Huu | QuantumEspresso; 6.2; 13949:13950 | PBE | Ultrasoft | -194128.629241; eV | ||
 | c4_Zn_O1 | Chuong Nguyën, Huu | QuantumEspresso; 6.2; 13949:13950 | PBE | Ultrasoft | -194129.121031; eV | ||
 | c5_Fe_O1 | Chuong Nguyën, Huu | QuantumEspresso; 6.2; 13949:13950 | PBE | Ultrasoft | -194129.006029; eV | ||
 | c5_Ni_O1 | Chuong Nguyën, Huu | QuantumEspresso; 6.2; 13949:13950 | PBE | Ultrasoft | -194129.738646; eV | ||
 | c5_Zn_O1_in2 | Chuong Nguyën, Huu | QuantumEspresso; 6.2; 13949:13950 | PBE | Ultrasoft | -194129.154027; eV |
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