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{
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{
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{
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{
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"structure_string": "Y24 Te8 Pd4\n1.0\n4.030256 0.000000 0.000000\n0.000000 11.534545 0.000000\n0.000000 0.000000 22.000544\nY Te Pd\n24 8 4\ndirect\n0.750000 0.575663 0.854454 Y\n0.250000 0.174163 0.391437 Y\n0.250000 0.885819 0.487575 Y\n0.750000 0.825837 0.608563 Y\n0.750000 0.879440 0.974732 Y\n0.750000 0.620560 0.474732 Y\n0.750000 0.385819 0.012425 Y\n0.250000 0.424337 0.145546 Y\n0.250000 0.075663 0.645546 Y\n0.250000 0.746078 0.233901 Y\n0.250000 0.041031 0.845975 Y\n0.250000 0.753922 0.733901 Y\n0.750000 0.253922 0.766099 Y\n0.750000 0.674163 0.108563 Y\n0.250000 0.120560 0.025268 Y\n0.750000 0.246078 0.266099 Y\n0.750000 0.541031 0.654025 Y\n0.250000 0.458969 0.345975 Y\n0.750000 0.958969 0.154025 Y\n0.750000 0.114181 0.512425 Y\n0.250000 0.325837 0.891437 Y\n0.750000 0.924337 0.354454 Y\n0.250000 0.614181 0.987575 Y\n0.250000 0.379440 0.525268 Y\n0.750000 0.969362 0.739046 Te\n0.750000 0.278322 0.626528 Te\n0.250000 0.778322 0.873472 Te\n0.250000 0.030638 0.260954 Te\n0.250000 0.721678 0.373472 Te\n0.250000 0.469362 0.760954 Te\n0.750000 0.221678 0.126528 Te\n0.750000 0.530638 0.239046 Te\n0.750000 0.145806 0.926597 Pd\n0.250000 0.854194 0.073403 Pd\n0.250000 0.645806 0.573403 Pd\n0.750000 0.354194 0.426597 Pd\n",
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{
"id": "mp-1113018",
"created_at": "2022-09-04T14:39:42.177721Z",
"structure_string": "Cs2 Li1 Dy1 Cl6\n1.0\n0.000000 5.310556 5.310556\n5.310556 0.000000 5.310556\n5.310556 5.310556 0.000000\nCs Li Dy Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Cs\n0.250000 0.250000 0.250000 Cs\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Dy\n0.750671 0.249329 0.249329 Cl\n0.249329 0.249329 0.750671 Cl\n0.249329 0.750671 0.750671 Cl\n0.249329 0.750671 0.249329 Cl\n0.750671 0.249329 0.750671 Cl\n0.750671 0.750671 0.249329 Cl\n",
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{
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"structure_string": "In1 Ge2 Sb1 Te5\n1.0\n2.132274 -3.693206 0.000000\n2.132274 3.693206 0.000000\n0.000000 0.000000 17.830967\nIn Ge Sb Te\n1 2 1 5\ndirect\n0.333333 0.666667 0.113558 In\n0.000000 0.000000 0.330710 Ge\n0.000000 0.000000 0.669178 Ge\n0.666667 0.333333 0.890200 Sb\n0.333333 0.666667 0.410636 Te\n0.666667 0.333333 0.588709 Te\n0.000000 0.000000 0.003345 Te\n0.333333 0.666667 0.792007 Te\n0.666667 0.333333 0.201658 Te\n",
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{
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"structure_string": "Ca3 V2 O8\n1.0\n2.792482 4.891233 0.000000\n-2.792482 4.891233 0.000000\n0.000000 3.249754 6.356668\nCa V O\n3 2 8\ndirect\n0.805091 0.805091 0.590840 Ca\n0.194909 0.194909 0.409160 Ca\n0.000000 0.000000 0.000000 Ca\n0.594050 0.594050 0.214203 V\n0.405950 0.405950 0.785797 V\n0.737999 0.224678 0.305273 O\n0.678218 0.678218 0.944687 O\n0.263826 0.263826 0.701370 O\n0.224678 0.737999 0.305273 O\n0.262001 0.775322 0.694727 O\n0.775322 0.262001 0.694727 O\n0.321782 0.321782 0.055313 O\n0.736174 0.736174 0.298630 O\n",
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{
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{
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"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0048423,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:44.731000Z",
"spacegroup": 11
}
]
}