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{
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{
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"structure_string": "Ho4 Zn4 Ge4\n1.0\n2.115590 -3.664309 0.000000\n2.115590 3.664309 0.000000\n0.000000 0.000000 15.463522\nHo Zn Ge\n4 4 4\ndirect\n0.000000 0.000000 0.250000 Ho\n0.000000 0.000000 0.750000 Ho\n0.000000 0.000000 0.000000 Ho\n0.000000 0.000000 0.500000 Ho\n0.333333 0.666667 0.146165 Zn\n0.666667 0.333333 0.853835 Zn\n0.666667 0.333333 0.646165 Zn\n0.333333 0.666667 0.353835 Zn\n0.333333 0.666667 0.611172 Ge\n0.666667 0.333333 0.388828 Ge\n0.666667 0.333333 0.111172 Ge\n0.333333 0.666667 0.888828 Ge\n",
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{
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{
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"structure_string": "U10 Se20\n1.0\n10.679688 0.000000 0.000000\n0.000000 10.679688 0.000000\n0.000000 0.000000 6.573770\nU Se\n10 20\ndirect\n0.840436 0.154568 0.249958 U\n0.654568 0.659564 0.249958 U\n0.345432 0.340436 0.249958 U\n0.159564 0.845432 0.249958 U\n0.500000 0.000000 0.858007 U\n0.340436 0.654568 0.750042 U\n0.154568 0.159564 0.750042 U\n0.845432 0.840436 0.750042 U\n0.659564 0.345432 0.750042 U\n0.000000 0.500000 0.141993 U\n0.709465 0.087431 0.618617 Se\n0.587431 0.790535 0.618617 Se\n0.412569 0.209465 0.618617 Se\n0.290535 0.912569 0.618617 Se\n0.707897 0.913665 0.114667 Se\n0.586335 0.207897 0.114667 Se\n0.413665 0.792103 0.114667 Se\n0.292103 0.086335 0.114667 Se\n0.500000 0.500000 0.000000 Se\n0.000000 0.000000 0.000000 Se\n0.207897 0.413665 0.885333 Se\n0.086335 0.707897 0.885333 Se\n0.913665 0.292103 0.885333 Se\n0.792103 0.586335 0.885333 Se\n0.500000 0.500000 0.500000 Se\n0.000000 0.000000 0.500000 Se\n0.209465 0.587431 0.381383 Se\n0.087431 0.290535 0.381383 Se\n0.912569 0.709465 0.381383 Se\n0.790535 0.412569 0.381383 Se\n",
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{
"id": "mp-568059",
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"structure_string": "Lu1 Bi1\n1.0\n0.000000 3.119416 3.119416\n3.119416 0.000000 3.119416\n3.119416 3.119416 0.000000\nLu Bi\n1 1\ndirect\n0.500000 0.500000 0.500000 Lu\n0.000000 0.000000 0.000000 Bi\n",
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{
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"created_at": "2022-09-04T14:43:34.033764Z",
"structure_string": "Si6 O6\n1.0\n2.266480 -3.925658 0.000000\n2.266480 3.925658 0.000000\n0.000000 0.000000 9.566267\nSi O\n6 6\ndirect\n0.000000 0.500000 0.107358 Si\n0.000000 0.500000 0.559308 Si\n0.500000 0.500000 0.892642 Si\n0.500000 0.500000 0.440691 Si\n0.500000 0.000000 0.774025 Si\n0.500000 0.000000 0.225975 Si\n0.168758 0.831242 0.666667 O\n0.168758 0.337516 0.000000 O\n0.662484 0.831242 0.333333 O\n0.337516 0.168758 0.333333 O\n0.831242 0.662484 0.000000 O\n0.831242 0.168758 0.666667 O\n",
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{
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{
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{
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"formula_full": "Sr1 Eu1 Gd1 Ge1 O6",
"formula_reduced": "SrEuGdGeO6",
"formula_anonymous": "ABCDE6",
"energy": -89.7696836,
"energy_per_atom": -8.976968359999999,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -85.6476836,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 13.0000003,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:17.973000Z",
"spacegroup": 216
}
]
}