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DS_z3s0qui5vg5c_0
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DFT-PBE-D3
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DS_z3s0qui5vg5c_0
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VASP
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DFT-PBE-D3
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DS_z3s0qui5vg5c_0
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DFT-PBE-D3
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| 2025-04-16T17:41:29
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DS_z3s0qui5vg5c_0
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VASP
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DFT-PBE-D3
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CCo17Cu8Fe13HMo16Ni10O
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A17B16C13D10E8FGH
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| 2025-04-17T17:45:49
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DS_z3s0qui5vg5c_0
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VASP
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DFT-PBE-D3
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CHCo14Cu14Fe16Mo14Ni6O
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CCo14Cu14Fe16HMo14Ni6O
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A16B14C14D14E6FGH
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data/MD/9477/MD_7059920210072549455889477.json
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PO_1017117782537667129910510
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DS_z3s0qui5vg5c_0
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VASP
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DFT-PBE-D3
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DS_z3s0qui5vg5c_0
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DS_z3s0qui5vg5c_0
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DS_z3s0qui5vg5c_0
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DFT-PBE-D3
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DS_z3s0qui5vg5c_0
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DS_z3s0qui5vg5c_0
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DFT-PBE-D3
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DS_z3s0qui5vg5c_0
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DS_z3s0qui5vg5c_0
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DS_z3s0qui5vg5c_0
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DS_z3s0qui5vg5c_0
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DFT-PBE-D3
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DS_z3s0qui5vg5c_0
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DFT-PBE-D3
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A15B13C12D12E12FGH
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DS_z3s0qui5vg5c_0
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DS_z3s0qui5vg5c_0
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VASP
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DFT-PBE-D3
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DS_z3s0qui5vg5c_0
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DFT-PBE-D3
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| 2025-04-16T15:45:48
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DS_z3s0qui5vg5c_0
| 1
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VASP
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DFT-PBE-D3
| null |
[] |
[] | null | null | null | null | -105.784686
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CO_1048781001790091510944581
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CHCo11Cu8Fe17Mo13Ni15O
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CCo11Cu8Fe17HMo13Ni15O
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A17B15C13D11E8FGH
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data/MD/0894/MD_1590319596876876097750894.json
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| 2025-04-16T18:01:58
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DS_z3s0qui5vg5c_0
| 1
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VASP
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DFT-PBE-D3
| null |
[] |
[] | null | null | null | null | -94.602266
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CHCo11Cu8Fe17Mo13Ni15O
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CCo11Cu8Fe17HMo13Ni15O
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A17B15C13D11E8FGH
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data/MD/6639/MD_5832233885444845278706639.json
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PO_1109580554685629137648197
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| 2025-04-16T17:11:08
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DS_z3s0qui5vg5c_0
| 1
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VASP
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DFT-PBE-D3
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[] |
[] | null | null | null | null | -84.124195
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CO_9984172798012618781736692
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DS_z3s0qui5vg5c_0
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DFT-PBE-D3
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DS_z3s0qui5vg5c_0
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DFT-PBE-D3
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DS_z3s0qui5vg5c_0
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DFT-PBE-D3
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DS_z3s0qui5vg5c_0
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DS_z3s0qui5vg5c_0
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DFT-PBE-D3
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DS_z3s0qui5vg5c_0
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DS_z3s0qui5vg5c_0
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DFT-PBE-D3
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DS_z3s0qui5vg5c_0
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DS_z3s0qui5vg5c_0
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DFT-PBE-D3
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DS_z3s0qui5vg5c_0
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| 2025-04-16T15:44:18
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DS_z3s0qui5vg5c_0
| 1
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VASP
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DFT-PBE-D3
| null |
[] |
[] | null | null | null | null | -83.964075
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CO_7956737568453878615181460
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CHCo13Cu13Fe14Mo13Ni11O
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CCo13Cu13Fe14HMo13Ni11O
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A14B13C13D13E11FGH
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data/MD/5043/MD_1080218064890941504605043.json
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| 2025-04-16T18:47:56
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DS_z3s0qui5vg5c_0
| 1
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VASP
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DFT-PBE-D3
| null |
[] |
[] | null | null | null | null | -109.00675
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CHCo14Cu14Fe16Mo14Ni6O
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CCo14Cu14Fe16HMo14Ni6O
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A16B14C14D14E6FGH
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data/MD/5516/MD_5256588522501730572235516.json
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| 2025-04-16T15:43:19
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DS_z3s0qui5vg5c_0
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VASP
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DFT-PBE-D3
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[] |
[] | null | null | null | null | -103.634456
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DS_z3s0qui5vg5c_0
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DFT-PBE-D3
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DS_z3s0qui5vg5c_0
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DS_z3s0qui5vg5c_0
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DS_z3s0qui5vg5c_0
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DFT-PBE-D3
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DS_z3s0qui5vg5c_0
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DS_z3s0qui5vg5c_0
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DFT-PBE-D3
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DS_z3s0qui5vg5c_0
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DS_z3s0qui5vg5c_0
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DS_z3s0qui5vg5c_0
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DS_z3s0qui5vg5c_0
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DS_z3s0qui5vg5c_0
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VASP
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DFT-PBE-D3
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CHCo15Cu12Fe13Mo12Ni12O
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CCo15Cu12Fe13HMo12Ni12O
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A15B13C12D12E12FGH
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DS_z3s0qui5vg5c_0
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DFT-PBE-D3
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PO_1215143088183726971767820
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DS_z3s0qui5vg5c_0
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VASP
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DFT-PBE-D3
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[] | null | null | null | null | -140.788265
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CHCo14Cu14Fe16Mo14Ni6O
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CCo14Cu14Fe16HMo14Ni6O
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A16B14C14D14E6FGH
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data/MD/4832/MD_9882597702904208680604832.json
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| 2025-04-16T18:29:07
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DS_z3s0qui5vg5c_0
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VASP
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DFT-PBE-D3
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[] |
[] | null | null | null | null | -88.096649
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CHCo15Cu12Fe13Mo12Ni12O
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CCo15Cu12Fe13HMo12Ni12O
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A15B13C12D12E12FGH
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data/MD/3976/MD_8984134417566022063473976.json
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PO_1217334633633320379787568
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DS_z3s0qui5vg5c_0
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VASP
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DFT-PBE-D3
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[] |
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DS_z3s0qui5vg5c_0
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DFT-PBE-D3
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DS_z3s0qui5vg5c_0
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DFT-PBE-D3
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DS_z3s0qui5vg5c_0
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DFT-PBE-D3
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DS_z3s0qui5vg5c_0
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DS_z3s0qui5vg5c_0
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DS_z3s0qui5vg5c_0
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DFT-PBE-D3
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DS_z3s0qui5vg5c_0
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DS_z3s0qui5vg5c_0
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DS_z3s0qui5vg5c_0
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data/MD/2201/MD_1293912552609144714462201.json
| null |
{"energy": -106.79480578611286, "id": "MD_1293912552609144714462201", "hash": "12939125526091447144622010171568380425329979631086523078953934828579905789879961995770171047875393154409787969542044595608733007314852168593811600177827802"}
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{"input": {"ediff": {"value": 0.0001, "units": "eV"}, "ediffg": {"value": 0.02, "units": "eV/angstrom"}, "encut": {"value": 550, "units": "eV"}, "kpoints": "4 x 4 x 1", "kpoints-scheme": "Monkhorst-Pack"}, "hash": "932945996022522316701014904236947747212114716292279553703054989511932234835160747746736195781843807711221827414012148640702572281911852795733632260071725", "id": "MD_9329459960225223167010149"}
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