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"formula_anonymous": "ABC3",
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"spacegroup": 19
},
{
"id": "jvasp-22852",
"created_at": "2022-09-04T14:37:32.040636Z",
"updated_at": "2022-09-04T14:37:32.040674Z",
"structure_string": "Er6 Al4 Ni12\n1.0\n7.238130 -0.000000 -2.559065\n-3.619065 6.268404 -2.559065\n0.000000 0.000000 7.677196\nEr Al Ni\n6 4 12\ndirect\n0.293737 -0.000000 0.293737 Er\n0.706262 0.706263 -0.000001 Er\n0.293737 0.293737 -0.000001 Er\n-0.000001 0.706263 0.706263 Er\n-0.000000 0.293737 0.293737 Er\n0.706263 -0.000000 0.706263 Er\n0.499999 0.500000 0.499999 Al\n-0.000000 -0.000000 0.500000 Al\n-0.000001 0.500000 -0.000001 Al\n0.500000 0.000000 -0.000000 Al\n0.665631 -0.000000 0.334368 Ni\n0.334369 -0.000000 0.665631 Ni\n0.334368 0.334368 0.668737 Ni\n0.668737 0.334368 0.334368 Ni\n0.665631 0.665631 0.331261 Ni\n0.665631 0.331262 0.665631 Ni\n-0.000001 0.665631 0.334368 Ni\n0.665631 0.334368 -0.000001 Ni\n-0.000000 0.334368 0.665631 Ni\n0.334368 0.665631 -0.000001 Ni\n0.334368 0.668737 0.334368 Ni\n0.331262 0.665631 0.665631 Ni\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Er",
"Al",
"Ni"
],
"chemical_system": "Al-Er-Ni",
"density": 8.65628110082943,
"density_atomic": 0.06315921076362566,
"volume": 348.3260752312968,
"volume_molar": 9.534857524641904,
"formula_full": "Er6 Al4 Ni12",
"formula_reduced": "Er3(AlNi3)2",
"formula_anonymous": "A2B3C6",
"energy_above_hull": 1.4496045454545454,
"spacegroup": 229
}
]
}