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{
"id": "mp-1211255",
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"nsites": 56,
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"elements": [
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"formula_full": "Al8 Se16 Cl32",
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{
"id": "mp-557002",
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"structure_string": "Pr9 O16\n1.0\n6.883551 0.000000 0.000000\n1.049149 6.932425 0.000000\n1.457051 2.322770 8.727227\nPr O\n9 16\ndirect\n0.671860 0.309206 0.671926 Pr\n0.328140 0.690794 0.328074 Pr\n0.408698 0.238391 0.100897 Pr\n0.229969 0.124384 0.526911 Pr\n0.000000 0.000000 0.000000 Pr\n0.107245 0.521342 0.773018 Pr\n0.892755 0.478658 0.226982 Pr\n0.591302 0.761609 0.899103 Pr\n0.770031 0.875616 0.473089 Pr\n0.070794 0.295598 0.044751 O\n0.779273 0.611883 0.702424 O\n0.527709 0.005306 0.663204 O\n0.646548 0.581083 0.428859 O\n0.929206 0.704402 0.955249 O\n0.124236 0.805574 0.545998 O\n0.353452 0.418917 0.571141 O\n0.974316 0.786774 0.256862 O\n0.668055 0.087537 0.940111 O\n0.220727 0.388117 0.297576 O\n0.025684 0.213226 0.743138 O\n0.423741 0.496727 0.858119 O\n0.472291 0.994694 0.336796 O\n0.576259 0.503273 0.141881 O\n0.875764 0.194426 0.454002 O\n0.331945 0.912463 0.059889 O\n",
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{
"id": "mp-1220493",
"created_at": "2022-09-04T14:44:09.986577Z",
"structure_string": "Nd5 Co5\n1.0\n5.794184 0.000000 0.000000\n2.897092 4.928290 0.036924\n0.000000 0.052250 7.415729\nNd Co\n5 5\ndirect\n0.662621 0.674759 0.872934 Nd\n0.337379 0.325241 0.127066 Nd\n0.840241 0.319518 0.427901 Nd\n0.159759 0.680482 0.572099 Nd\n0.000000 0.000000 0.000000 Nd\n0.500000 0.000000 0.500000 Co\n0.608575 0.201305 0.739381 Co\n0.809880 0.798695 0.260619 Co\n0.391425 0.798695 0.260619 Co\n0.190120 0.201305 0.739381 Co\n",
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"volume": 211.74807067262967,
"volume_molar": 12.751766872490037,
"formula_full": "Nd5 Co5",
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"spacegroup": 12
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{
"id": "mp-41283",
"created_at": "2022-09-04T14:44:09.986676Z",
"structure_string": "Ba1 La1 Ta1 Mn1 O6\n1.0\n0.000000 4.126637 4.126637\n4.126637 0.000000 4.126637\n4.126637 4.126637 0.000000\nBa La Ta Mn O\n1 1 1 1 6\ndirect\n0.250000 0.250000 0.250000 Ba\n0.750000 0.750000 0.750000 La\n0.000000 0.000000 0.000000 Ta\n0.500000 0.500000 0.500000 Mn\n0.758783 0.241217 0.758783 O\n0.758783 0.241217 0.241217 O\n0.758783 0.758783 0.241217 O\n0.241217 0.241217 0.758783 O\n0.241217 0.758783 0.758783 O\n0.241217 0.758783 0.241217 O\n",
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{
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{
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{
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{
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{
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{
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{
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}