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{
"id": "mp-1220274",
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{
"id": "mp-1186819",
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{
"id": "mp-567395",
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"structure_string": "Li30 Au8\n1.0\n-5.412847 5.412847 5.412847\n5.412847 -5.412847 5.412847\n5.412847 5.412847 -5.412847\nLi Au\n30 8\ndirect\n0.379974 0.656442 0.960245 Li\n0.039755 0.919729 0.696197 Li\n0.696197 0.039755 0.919729 Li\n0.750000 0.875000 0.125000 Li\n0.460245 0.156442 0.879974 Li\n0.120026 0.080271 0.276468 Li\n0.419729 0.539755 0.196197 Li\n0.580271 0.620026 0.776468 Li\n0.776468 0.580271 0.620026 Li\n0.539755 0.196197 0.419729 Li\n0.723532 0.343558 0.803803 Li\n0.156442 0.879974 0.460245 Li\n0.843558 0.223532 0.303803 Li\n0.080271 0.276468 0.120026 Li\n0.196197 0.419729 0.539755 Li\n0.375000 0.250000 0.625000 Li\n0.960245 0.379974 0.656442 Li\n0.125000 0.750000 0.875000 Li\n0.620026 0.776468 0.580271 Li\n0.656442 0.960245 0.379974 Li\n0.343558 0.803803 0.723532 Li\n0.276468 0.120026 0.080271 Li\n0.803803 0.723532 0.343558 Li\n0.223532 0.303803 0.843558 Li\n0.919729 0.696197 0.039755 Li\n0.879974 0.460245 0.156442 Li\n0.875000 0.125000 0.750000 Li\n0.303803 0.843558 0.223532 Li\n0.250000 0.625000 0.375000 Li\n0.625000 0.375000 0.250000 Li\n0.000000 0.086774 0.500000 Au\n0.913226 0.913226 0.913226 Au\n0.413226 0.413226 0.413226 Au\n0.086774 0.500000 0.000000 Au\n0.500000 0.000000 0.086774 Au\n0.500000 0.000000 0.586774 Au\n0.000000 0.586774 0.500000 Au\n0.586774 0.500000 0.000000 Au\n",
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"elements": [
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"density": 4.669792522445063,
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"volume": 634.3621256638567,
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"formula_full": "Li30 Au8",
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"spacegroup": 220
},
{
"id": "mp-1185877",
"created_at": "2022-09-04T14:39:48.028062Z",
"structure_string": "Mg2 Hg4\n1.0\n1.644471 6.689089 0.000000\n-1.644471 6.689089 0.000000\n0.000000 2.531245 6.375566\nMg Hg\n2 4\ndirect\n0.139081 0.139081 0.465357 Mg\n0.860919 0.860919 0.534643 Mg\n0.197550 0.197550 0.844764 Hg\n0.802450 0.802450 0.155236 Hg\n0.527933 0.527933 0.210128 Hg\n0.472067 0.472067 0.789872 Hg\n",
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"spacegroup": 12
},
{
"id": "mp-1183399",
"created_at": "2022-09-04T14:40:00.909140Z",
"structure_string": "Ba1 Yb3\n1.0\n0.000000 4.467475 4.467475\n4.467475 0.000000 4.467475\n4.467476 4.467475 0.000000\nBa Yb\n1 3\ndirect\n0.000000 0.000000 0.000000 Ba\n0.250000 0.250000 0.250000 Yb\n0.750000 0.750000 0.750000 Yb\n0.500000 0.500000 0.500000 Yb\n",
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"formula_full": "Ba1 Yb3",
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"updated_at": "2021-11-28T01:34:47.359000Z",
"spacegroup": 225
},
{
"id": "mp-7898",
"created_at": "2022-09-04T14:40:03.991672Z",
"structure_string": "Rb6 As2\n1.0\n3.091289 -5.354270 0.000000\n3.091289 5.354270 0.000000\n0.000000 0.000000 10.891388\nRb As\n6 2\ndirect\n0.333333 0.666667 0.578275 Rb\n0.666667 0.333333 0.078275 Rb\n0.666667 0.333333 0.421725 Rb\n0.333333 0.666667 0.921725 Rb\n0.000000 0.000000 0.750000 Rb\n0.000000 0.000000 0.250000 Rb\n0.666667 0.333333 0.750000 As\n0.333333 0.666667 0.250000 As\n",
"nsites": 8,
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"elements": [
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"formula_full": "Rb6 As2",
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"spacegroup": 194
},
{
"id": "mp-1079534",
"created_at": "2022-09-04T14:39:45.829476Z",
"structure_string": "Eu2 P6\n1.0\n3.619188 4.497360 0.000000\n-3.619188 4.497360 0.000000\n0.000000 2.140223 5.084125\nEu P\n2 6\ndirect\n0.164244 0.164244 0.655608 Eu\n0.835756 0.835756 0.344392 Eu\n0.901372 0.376479 0.185870 P\n0.376479 0.901372 0.185870 P\n0.098628 0.623521 0.814130 P\n0.623521 0.098628 0.814130 P\n0.504516 0.504516 0.204875 P\n0.495484 0.495484 0.795125 P\n",
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"formula_full": "Eu2 P6",
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},
{
"id": "mp-1094506",
"created_at": "2022-09-04T14:40:03.841212Z",
"structure_string": "Mg2 Ti4\n1.0\n1.475508 -7.960140 0.000000\n1.475508 7.960140 0.000000\n0.000000 0.000000 4.799702\nMg Ti\n2 4\ndirect\n0.782318 0.217682 0.250000 Mg\n0.217682 0.782318 0.750000 Mg\n0.099642 0.900358 0.250000 Ti\n0.450063 0.549937 0.250000 Ti\n0.549937 0.450063 0.750000 Ti\n0.900358 0.099642 0.750000 Ti\n",
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},
{
"id": "mp-1185779",
"created_at": "2022-09-04T14:40:01.211491Z",
"structure_string": "Mg4 Sc2\n1.0\n1.603500 6.037822 0.000000\n-1.603500 6.037822 0.000000\n0.000000 1.932336 7.244296\nMg Sc\n4 2\ndirect\n0.196230 0.196230 0.857540 Mg\n0.858747 0.858747 0.530273 Mg\n0.141253 0.141253 0.469727 Mg\n0.803770 0.803770 0.142460 Mg\n0.475720 0.475720 0.804054 Sc\n0.524280 0.524280 0.195946 Sc\n",
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{
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"structure_string": "Ga10 Pd2\n1.0\n-3.260343 3.260343 5.056796\n3.260343 -3.260343 5.056796\n3.260343 3.260343 -5.056796\nGa Pd\n10 2\ndirect\n0.000000 0.000000 0.000000 Ga\n0.500000 0.500000 0.000000 Ga\n0.785269 0.285269 0.791656 Ga\n0.285269 0.493613 0.500000 Ga\n0.993613 0.785269 0.500000 Ga\n0.714731 0.506387 0.500000 Ga\n0.006387 0.214731 0.500000 Ga\n0.506387 0.006387 0.791656 Ga\n0.214731 0.714731 0.208344 Ga\n0.493613 0.993613 0.208344 Ga\n0.250000 0.250000 0.000000 Pd\n0.750000 0.750000 0.000000 Pd\n",
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{
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{
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"structure_string": "Ni9 O13\n1.0\n2.926393 0.000400 -0.000621\n-1.462611 4.885843 -0.782859\n-0.002999 -0.159881 15.807677\nNi O\n9 13\ndirect\n0.500000 0.000000 0.500000 Ni\n0.649015 0.297745 0.045725 Ni\n0.350985 0.702255 0.954275 Ni\n0.749890 0.500133 0.412406 Ni\n0.250110 0.499867 0.587594 Ni\n0.937558 0.874770 0.124265 Ni\n0.062442 0.125230 0.875735 Ni\n0.996777 0.993796 0.334604 Ni\n0.003223 0.006204 0.665396 Ni\n0.000000 0.000000 0.000000 O\n0.880338 0.760862 0.231029 O\n0.119662 0.239138 0.768971 O\n0.300752 0.600873 0.072177 O\n0.699248 0.399127 0.927823 O\n0.565830 0.132355 0.149000 O\n0.434170 0.867645 0.851000 O\n0.608870 0.218235 0.307285 O\n0.391130 0.781765 0.692715 O\n0.383152 0.767346 0.385927 O\n0.616848 0.232654 0.614073 O\n0.125298 0.250704 0.456149 O\n0.874702 0.749296 0.543851 O\n",
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}
]
}