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{
"id": "jvasp-9729",
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"structure_string": "Sr4 Zn4 O8\n1.0\n3.358940 0.000000 0.000000\n-0.000000 5.866866 0.000000\n0.000000 0.000000 11.389466\nSr Zn O\n4 4 8\ndirect\n0.250000 0.318993 0.632969 Sr\n0.750000 0.681008 0.367032 Sr\n0.250000 0.818993 0.867032 Sr\n0.750000 0.181008 0.132968 Sr\n0.750000 0.805983 0.628106 Zn\n0.750000 0.305983 0.871895 Zn\n0.250000 0.194018 0.371895 Zn\n0.250000 0.694018 0.128106 Zn\n0.250000 0.238797 0.961222 O\n0.750000 0.761204 0.038778 O\n0.250000 0.738797 0.538778 O\n0.750000 0.261204 0.461222 O\n0.250000 0.441000 0.241205 O\n0.750000 0.059001 0.741205 O\n0.250000 0.941000 0.258795 O\n0.750000 0.559001 0.758795 O\n",
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{
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"updated_at": "2022-09-04T14:37:07.610151Z",
"structure_string": "Sm4 Cu4 S8\n1.0\n0.000000 6.440344 0.007069\n7.131200 0.000000 0.000000\n0.000000 -0.891927 -6.778079\nSm Cu S\n4 4 8\ndirect\n0.808178 0.951038 0.199117 Sm\n0.191821 0.451038 0.300883 Sm\n0.191821 0.048962 0.800883 Sm\n0.808178 0.548962 0.699117 Sm\n0.422864 0.661757 0.949755 Cu\n0.577135 0.338243 0.050245 Cu\n0.577134 0.161757 0.550245 Cu\n0.422865 0.838243 0.449755 Cu\n0.079521 0.726042 0.999393 S\n0.920478 0.226042 0.500607 S\n0.920478 0.273958 0.000607 S\n0.079521 0.773958 0.499393 S\n0.406800 0.113151 0.218815 S\n0.406799 0.386849 0.718815 S\n0.593199 0.886849 0.781185 S\n0.593200 0.613151 0.281185 S\n",
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"density_atomic": 0.05140488669613565,
"volume": 311.2544551372933,
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"formula_full": "Sm4 Cu4 S8",
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{
"id": "jvasp-35972",
"created_at": "2022-09-04T14:37:15.057201Z",
"updated_at": "2022-09-04T14:37:15.057230Z",
"structure_string": "Li1 Sn1 S2\n1.0\n-1.907015 -3.303047 -0.000000\n-3.814030 0.000000 -0.000000\n-1.907015 -1.101016 -6.233321\nLi Sn S\n1 1 2\ndirect\n0.500001 0.499998 0.500000 Li\n0.000000 0.000000 0.000000 Sn\n0.754296 0.754291 0.737119 S\n0.245707 0.245705 0.262881 S\n",
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"formula_full": "Li1 Sn1 S2",
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},
{
"id": "jvasp-9530",
"created_at": "2022-09-04T14:37:19.786271Z",
"updated_at": "2022-09-04T14:37:19.786290Z",
"structure_string": "Mg4 Cr4 O8\n1.0\n2.919338 0.000949 0.003889\n1.457239 8.346587 0.115070\n1.448536 0.480298 8.303608\nMg Cr O\n4 4 8\ndirect\n0.650449 0.936166 0.763009 Mg\n0.353653 0.083918 0.208786 Mg\n0.925013 0.292415 0.857774 Mg\n0.079204 0.727667 0.114027 Mg\n0.371676 0.821824 0.434872 Cr\n0.788999 0.616862 0.805292 Cr\n0.215193 0.403220 0.166511 Cr\n0.632450 0.198262 0.536925 Cr\n0.188902 0.235769 0.386485 O\n0.631508 0.571184 0.165907 O\n0.372697 0.448898 0.805890 O\n0.815223 0.784316 0.585313 O\n0.918379 0.907701 0.255595 O\n0.166533 0.787873 0.879192 O\n0.085745 0.112383 0.716203 O\n0.837619 0.232210 0.092606 O\n",
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{
"id": "jvasp-9735",
"created_at": "2022-09-04T14:37:11.180720Z",
"updated_at": "2022-09-04T14:37:11.180751Z",
"structure_string": "Tb4 Cu4 S8\n1.0\n0.000000 6.377058 0.009707\n7.029975 0.000000 0.000000\n0.000000 -0.863632 -6.705889\nTb Cu S\n4 4 8\ndirect\n0.306595 0.047891 0.698576 Tb\n0.693406 0.547891 0.801423 Tb\n0.693406 0.952110 0.301423 Tb\n0.306595 0.452110 0.198576 Tb\n0.081485 0.840012 0.051157 Cu\n0.918515 0.159989 0.948842 Cu\n0.918515 0.340012 0.448842 Cu\n0.081485 0.659989 0.551157 Cu\n0.426183 0.726494 0.501186 S\n0.573817 0.226494 0.998814 S\n0.573817 0.273506 0.498814 S\n0.426183 0.773507 0.001186 S\n0.093666 0.386768 0.783297 S\n0.093666 0.113232 0.283297 S\n0.906335 0.613232 0.216702 S\n0.906335 0.886769 0.716702 S\n",
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"density_atomic": 0.05323222517349812,
"volume": 300.5698136392327,
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"formula_full": "Tb4 Cu4 S8",
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{
"id": "jvasp-79065",
"created_at": "2022-09-04T14:37:11.183325Z",
"updated_at": "2022-09-04T14:37:11.183350Z",
"structure_string": "Na1 Tl2 Pd1\n1.0\n0.000009 3.526414 3.526430\n3.526430 0.000006 3.526434\n3.526431 3.526418 0.000006\nNa Tl Pd\n1 2 1\ndirect\n0.250000 0.250000 0.250001 Na\n0.000000 0.000000 0.000000 Tl\n0.500000 0.500001 0.500000 Tl\n0.750000 0.750000 0.750000 Pd\n",
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},
{
"id": "jvasp-81061",
"created_at": "2022-09-04T14:37:11.185901Z",
"updated_at": "2022-09-04T14:37:11.185922Z",
"structure_string": "Nb1 Sn1 Ru2\n1.0\n-9.117269 -0.000000 -5.263858\n-5.843988 -1.158194 -0.405632\n-4.441107 2.809750 -2.835491\nNb Sn Ru\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Nb\n0.500000 -0.000000 -0.000000 Sn\n0.769779 -0.000000 -0.000000 Ru\n0.230222 -0.000000 -0.000000 Ru\n",
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{
"id": "jvasp-79287",
"created_at": "2022-09-04T14:37:11.189752Z",
"updated_at": "2022-09-04T14:37:11.189778Z",
"structure_string": "Sr1 La1 Zr2\n1.0\n0.000000 3.905791 3.905791\n3.905791 0.000000 3.905791\n3.905791 3.905791 0.000000\nSr La Zr\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Sr\n0.000000 0.000000 0.000000 La\n0.750000 0.750000 0.750000 Zr\n0.250000 0.250000 0.250000 Zr\n",
"nsites": 4,
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{
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"created_at": "2022-09-04T14:37:15.105830Z",
"updated_at": "2022-09-04T14:37:15.105850Z",
"structure_string": "Li1 Nb1 Ru2\n1.0\n-9.719374 1.889179 -2.584858\n-6.510896 -0.125741 0.652456\n-5.196076 3.672004 -1.631907\nLi Nb Ru\n1 1 2\ndirect\n-0.000000 0.000010 -0.000009 Li\n0.500001 0.000003 -0.000004 Nb\n0.736507 0.008813 0.010277 Ru\n0.263494 -0.008827 -0.010263 Ru\n",
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{
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"created_at": "2022-09-04T14:37:11.191717Z",
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"structure_string": "Yb1 In1 Au2\n1.0\n4.265120 0.000000 2.462468\n1.421707 4.021194 2.462468\n0.000000 0.000000 4.924937\nYb In Au\n1 1 2\ndirect\n0.500001 0.499999 0.500001 Yb\n0.000000 0.000000 0.000000 In\n0.250000 0.250000 0.250000 Au\n0.750001 0.749999 0.750001 Au\n",
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{
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"created_at": "2022-09-04T14:37:11.194586Z",
"updated_at": "2022-09-04T14:37:11.194607Z",
"structure_string": "Li4 Al4 O8\n1.0\n5.201815 -0.000000 -0.000000\n0.000000 5.201815 0.000000\n-0.000000 -0.000000 6.267666\nLi Al O\n4 4 8\ndirect\n0.686555 0.313446 0.250000 Li\n0.186555 0.186555 0.500000 Li\n0.313446 0.686555 0.750001 Li\n0.813446 0.813446 0.000000 Li\n0.825174 0.825174 0.500000 Al\n0.674827 0.325174 0.750001 Al\n0.325174 0.674827 0.250000 Al\n0.174827 0.174827 0.000000 Al\n0.293083 0.334086 0.229840 O\n0.165914 0.793084 0.479840 O\n0.793084 0.165914 0.520160 O\n0.834087 0.206917 0.979841 O\n0.206917 0.834087 0.020160 O\n0.665915 0.706918 0.270160 O\n0.334086 0.293083 0.770160 O\n0.706918 0.665915 0.729841 O\n",
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}
]
}