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{
"id": "mp-1206408",
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"structure_string": "K4 C1\n1.0\n-5.309139 5.309139 -2.048726\n5.309139 -5.309139 -2.048726\n-5.309139 -5.309139 2.048726\nK C\n4 1\ndirect\n0.731489 0.500000 0.231489 K\n0.268511 0.500000 0.768511 K\n0.500000 0.731489 0.231489 K\n0.500000 0.268511 0.768511 K\n0.000000 0.000000 0.000000 C\n",
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{
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{
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"structure_string": "K1 C1\n1.0\n0.000000 3.092474 3.092474\n3.092474 0.000000 3.092474\n3.092474 3.092474 0.000000\nK C\n1 1\ndirect\n0.000000 0.000000 0.000000 K\n0.500000 0.500000 0.500000 C\n",
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{
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"structure_string": "K1 Br1\n1.0\n0.000000 3.351538 3.351538\n3.351538 0.000000 3.351538\n3.351538 3.351538 0.000000\nK Br\n1 1\ndirect\n0.000000 0.000000 0.000000 K\n0.500000 0.500000 0.500000 Br\n",
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{
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{
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{
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{
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"formula_reduced": "K3Bi2",
"formula_anonymous": "A2B3",
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"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
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"energy_uncorrected": -25.52610842,
"band_gap": 0.0,
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"is_magnetic": false,
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"is_theoretical": true,
"updated_at": "2021-11-28T01:36:08.763000Z",
"spacegroup": 15
},
{
"id": "mp-568516",
"created_at": "2022-09-04T14:47:33.316007Z",
"structure_string": "K3 Bi1\n1.0\n0.000000 4.362548 4.362548\n4.362548 0.000000 4.362548\n4.362548 4.362548 0.000000\nK Bi\n3 1\ndirect\n0.750000 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.500000 K\n0.000000 0.000000 0.000000 Bi\n",
"nsites": 4,
"nelements": 2,
"elements": [
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"Bi"
],
"chemical_system": "Bi-K",
"density": 3.2627413291402076,
"density_atomic": 0.024088476883591232,
"volume": 166.05450063655746,
"volume_molar": 25.000089416621467,
"formula_full": "K3 Bi1",
"formula_reduced": "K3Bi",
"formula_anonymous": "AB3",
"energy": -8.59269642,
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"energy_uncorrected": -8.59269642,
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"total_magnetization": 0.0002654,
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"updated_at": "2021-11-28T01:38:13.063000Z",
"spacegroup": 225
}
]
}