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{
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{
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{
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"id": "mp-582119",
"created_at": "2022-09-04T14:45:15.906606Z",
"structure_string": "Tb16 In4 Rh4\n1.0\n0.000000 6.863665 6.863665\n6.863665 0.000000 6.863665\n6.863665 6.863665 0.000000\nTb In Rh\n16 4 4\ndirect\n0.810402 0.810402 0.189598 Tb\n0.810402 0.189598 0.810402 Tb\n0.189598 0.189598 0.810402 Tb\n0.650442 0.048674 0.650442 Tb\n0.062423 0.062423 0.437577 Tb\n0.437577 0.437577 0.062423 Tb\n0.650442 0.650442 0.650442 Tb\n0.810402 0.189598 0.189598 Tb\n0.189598 0.810402 0.810402 Tb\n0.048674 0.650442 0.650442 Tb\n0.437577 0.062423 0.062423 Tb\n0.437577 0.062423 0.437577 Tb\n0.062423 0.437577 0.062423 Tb\n0.650442 0.650442 0.048674 Tb\n0.189598 0.810402 0.189598 Tb\n0.062423 0.437577 0.437577 Tb\n0.417656 0.417656 0.417656 In\n0.417656 0.417656 0.747031 In\n0.417656 0.747031 0.417656 In\n0.747031 0.417656 0.417656 In\n0.857683 0.426952 0.857683 Rh\n0.857683 0.857683 0.857683 Rh\n0.857683 0.857683 0.426952 Rh\n0.426952 0.857683 0.857683 Rh\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Tb",
"In",
"Rh"
],
"chemical_system": "In-Rh-Tb",
"density": 8.765489377555024,
"density_atomic": 0.03711188474591956,
"volume": 646.6931055728393,
"volume_molar": 16.22698712617158,
"formula_full": "Tb16 In4 Rh4",
"formula_reduced": "Tb4InRh",
"formula_anonymous": "ABC4",
"energy": -127.60064517,
"energy_per_atom": -5.31669354875,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -127.60064517,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0640262,
"is_theoretical": false,
"updated_at": "2021-11-28T01:37:00.160000Z",
"spacegroup": 216
}
]
}