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{
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{
"id": "mp-1028278",
"created_at": "2022-09-04T14:40:52.309520Z",
"structure_string": "Ca1 Ce1 Mg14\n1.0\n6.630734 0.000000 -0.000000\n-3.315367 5.742384 0.000000\n-0.000000 -0.000000 10.352853\nCa Ce Mg\n1 1 14\ndirect\n0.166667 0.333333 0.125000 Ca\n0.166667 0.333333 0.625000 Ce\n0.173479 0.836739 0.125000 Mg\n0.177762 0.838880 0.625000 Mg\n0.663261 0.326521 0.125000 Mg\n0.661120 0.322238 0.625000 Mg\n0.663261 0.836739 0.125000 Mg\n0.661120 0.838880 0.625000 Mg\n0.338431 0.161569 0.375638 Mg\n0.338431 0.161569 0.874362 Mg\n0.338431 0.676863 0.375638 Mg\n0.338431 0.676863 0.874362 Mg\n0.823137 0.161569 0.375638 Mg\n0.823137 0.161569 0.874362 Mg\n0.833333 0.666667 0.379566 Mg\n0.833333 0.666667 0.870434 Mg\n",
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{
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"formula_full": "Ce1 Al1 O2",
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},
{
"id": "mp-1207000",
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"structure_string": "Dy1 Bi1 O3\n1.0\n4.422165 0.000000 0.000000\n0.000000 4.422165 0.000000\n0.000000 0.000000 4.422165\nDy Bi O\n1 1 3\ndirect\n0.500000 0.500000 0.500000 Dy\n0.000000 0.000000 0.000000 Bi\n0.500000 0.000000 0.000000 O\n0.000000 0.500000 0.000000 O\n0.000000 0.000000 0.500000 O\n",
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"volume": 86.47783908075132,
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"formula_full": "Dy1 Bi1 O3",
"formula_reduced": "DyBiO3",
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"updated_at": "2021-11-28T01:38:11.364000Z",
"spacegroup": 221
},
{
"id": "mp-1112902",
"created_at": "2022-09-04T14:47:46.120141Z",
"structure_string": "Cs2 Hg1 Sb1 Cl6\n1.0\n0.000000 5.587089 5.587089\n5.587089 0.000000 5.587089\n5.587089 5.587089 0.000000\nCs Hg Sb 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 Hg\n0.000000 0.000000 0.000000 Sb\n0.763478 0.236522 0.236522 Cl\n0.236522 0.236522 0.763478 Cl\n0.236522 0.763478 0.763478 Cl\n0.236522 0.763478 0.236522 Cl\n0.763478 0.236522 0.763478 Cl\n0.763478 0.763478 0.236522 Cl\n",
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"elements": [
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"volume": 348.8082628513751,
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"formula_full": "Cs2 Hg1 Sb1 Cl6",
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"formula_anonymous": "ABC2D6",
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{
"id": "mp-1024985",
"created_at": "2022-09-04T14:39:14.178768Z",
"structure_string": "Er2 Al2 Ge2\n1.0\n2.028548 -5.179835 0.000000\n2.028548 5.179835 0.000000\n0.000000 0.000000 5.731814\nEr Al Ge\n2 2 2\ndirect\n0.689773 0.310227 0.250000 Er\n0.310227 0.689773 0.750000 Er\n0.000000 0.000000 0.000000 Al\n0.000000 0.000000 0.500000 Al\n0.393093 0.606907 0.250000 Ge\n0.606907 0.393093 0.750000 Ge\n",
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"updated_at": "2021-11-28T01:34:44.024000Z",
"spacegroup": 63
},
{
"id": "mp-1025252",
"created_at": "2022-09-04T14:47:16.747402Z",
"structure_string": "Cs2 Mn1 Cl4\n1.0\n-2.612579 2.612579 8.539798\n2.612579 -2.612579 8.539798\n2.612579 2.612579 -8.539798\nCs Mn Cl\n2 1 4\ndirect\n0.356477 0.356477 0.000000 Cs\n0.643523 0.643523 0.000000 Cs\n0.000000 0.000000 0.000000 Mn\n0.147189 0.147189 0.000000 Cl\n0.852811 0.852811 0.000000 Cl\n0.500000 0.000000 0.500000 Cl\n0.000000 0.500000 0.500000 Cl\n",
"nsites": 7,
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"density_atomic": 0.030022827250142204,
"volume": 233.15592304741534,
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"formula_full": "Cs2 Mn1 Cl4",
"formula_reduced": "Cs2MnCl4",
"formula_anonymous": "AB2C4",
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"spacegroup": 139
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{
"id": "mp-1027943",
"created_at": "2022-09-04T14:42:13.468064Z",
"structure_string": "K1 Mg14 Zr1\n1.0\n6.562020 -0.052050 0.000000\n-3.326087 5.760950 0.000000\n0.000000 0.000000 10.381489\nK Mg Zr\n1 14 1\ndirect\n0.163688 0.831844 0.125000 K\n0.165386 0.332692 0.625000 Mg\n0.167791 0.833895 0.625000 Mg\n0.662949 0.328551 0.125000 Mg\n0.667876 0.332004 0.625000 Mg\n0.662949 0.834397 0.125000 Mg\n0.667876 0.835871 0.625000 Mg\n0.334875 0.178451 0.382511 Mg\n0.334875 0.178451 0.867489 Mg\n0.334875 0.656425 0.382511 Mg\n0.334875 0.656425 0.867489 Mg\n0.838651 0.169326 0.371306 Mg\n0.838651 0.169326 0.878694 Mg\n0.820993 0.660497 0.385034 Mg\n0.820993 0.660497 0.864966 Mg\n0.182698 0.341349 0.125000 Zr\n",
"nsites": 16,
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"volume": 390.6590260825738,
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{
"id": "mp-1214057",
"created_at": "2022-09-04T14:40:00.880545Z",
"structure_string": "Ca8 Pt2\n1.0\n-5.830417 -5.830417 0.000000\n-5.830417 0.000000 -5.830417\n0.000000 -5.830417 -5.830417\nCa Pt\n8 2\ndirect\n0.616637 0.616637 0.616637 Ca\n0.150089 0.616637 0.616637 Ca\n0.616637 0.150089 0.616637 Ca\n0.599911 0.133363 0.133363 Ca\n0.133363 0.133363 0.133363 Ca\n0.616637 0.616637 0.150089 Ca\n0.133363 0.599911 0.133363 Ca\n0.133363 0.133363 0.599911 Ca\n0.000000 0.000000 0.000000 Pt\n0.750000 0.750000 0.750000 Pt\n",
"nsites": 10,
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"elements": [
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"volume": 396.3956203105822,
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"formula_full": "Ca8 Pt2",
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{
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"structure_string": "Pr1 B1 Pd3\n1.0\n4.397572 0.000000 0.000000\n0.000000 4.397572 0.000000\n0.000000 0.000000 4.397572\nPr B Pd\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Pr\n0.500000 0.500000 0.500000 B\n0.000000 0.500000 0.500000 Pd\n0.500000 0.500000 0.000000 Pd\n0.500000 0.000000 0.500000 Pd\n",
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{
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{
"id": "mp-1186960",
"created_at": "2022-09-04T14:44:09.192706Z",
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"volume": 249.25584792390265,
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"formula_full": "Sb2 Pb6",
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{
"id": "mp-996943",
"created_at": "2022-09-04T14:48:30.210575Z",
"structure_string": "Cs2 Na1 In1 Br6\n1.0\n0.000000 5.678365 5.678365\n5.678365 0.000000 5.678365\n5.678365 5.678365 0.000000\nCs Na In Br\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 Na\n0.000000 0.000000 0.000000 In\n0.760701 0.239299 0.239299 Br\n0.239299 0.239299 0.760701 Br\n0.239299 0.760701 0.760701 Br\n0.239299 0.760701 0.239299 Br\n0.760701 0.239299 0.760701 Br\n0.760701 0.760701 0.239299 Br\n",
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]
}