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{
"id": "jvasp-29339",
"created_at": "2022-09-04T14:37:05.740678Z",
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"structure_string": "Nb2 Se4 Br4\n1.0\n6.233294 0.000503 2.500822\n2.587680 5.731136 2.561664\n0.033479 0.011220 7.430995\nNb Se Br\n2 4 4\ndirect\n0.875270 0.251966 0.999500 Nb\n0.124730 0.748034 0.000498 Nb\n0.741148 0.039071 0.863814 Se\n0.258852 0.960929 0.136184 Se\n0.081364 0.092074 0.669820 Se\n0.918636 0.907926 0.330179 Se\n0.582707 0.649534 0.769239 Br\n0.417293 0.350466 0.230760 Br\n0.828399 0.521721 0.229963 Br\n0.171600 0.478279 0.770036 Br\n",
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{
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{
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"structure_string": "Nd1 P2 Ru2\n1.0\n3.815160 -0.000000 -1.446577\n-0.548493 3.775527 -1.446577\n0.022419 0.025912 5.813413\nNd P Ru\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Nd\n0.367582 0.367582 0.735163 P\n0.632418 0.632418 0.264835 P\n0.750000 0.250000 0.499999 Ru\n0.250001 0.750000 0.500000 Ru\n",
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"formula_full": "Nd1 P2 Ru2",
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{
"id": "jvasp-7752",
"created_at": "2022-09-04T14:37:06.167680Z",
"updated_at": "2022-09-04T14:37:06.167691Z",
"structure_string": "Dy2 S1 O2\n1.0\n1.898809 -3.288833 0.000000\n1.898809 3.288833 -0.000000\n0.000000 0.000000 6.598157\nDy S O\n2 1 2\ndirect\n0.666667 0.333333 0.281874 Dy\n0.333333 0.666667 0.718127 Dy\n0.000000 0.000000 0.000000 S\n0.666667 0.333333 0.629507 O\n0.333333 0.666667 0.370493 O\n",
"nsites": 5,
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"elements": [
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"spacegroup": 164
},
{
"id": "jvasp-57000",
"created_at": "2022-09-04T14:37:05.794297Z",
"updated_at": "2022-09-04T14:37:05.794312Z",
"structure_string": "Yb1 P2 Ru2\n1.0\n3.792928 0.000000 -1.484889\n-0.581317 3.748116 -1.484889\n0.001736 0.002026 5.591117\nYb P Ru\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Yb\n0.370766 0.370766 0.741531 P\n0.629235 0.629236 0.258470 P\n0.750001 0.250001 0.500000 Ru\n0.250000 0.750001 0.500000 Ru\n",
"nsites": 5,
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"density": 9.129486999416072,
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{
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"created_at": "2022-09-04T14:37:05.956718Z",
"updated_at": "2022-09-04T14:37:05.956744Z",
"structure_string": "Na2 Pd1 C2\n1.0\n2.224146 -3.852335 0.000000\n2.224146 3.852335 -0.000000\n0.000000 0.000000 5.273029\nNa Pd C\n2 1 2\ndirect\n0.333334 0.666668 0.280005 Na\n0.666668 0.333334 0.719996 Na\n0.000000 0.000000 0.000000 Pd\n0.000000 0.000000 0.380241 C\n0.000000 0.000000 0.619760 C\n",
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{
"id": "jvasp-7660",
"created_at": "2022-09-04T14:37:06.032019Z",
"updated_at": "2022-09-04T14:37:06.032043Z",
"structure_string": "Lu2 Al1 Si2\n1.0\n3.737097 -0.000000 1.474083\n1.171149 4.725197 2.505088\n-0.000268 -0.020074 5.474864\nLu Al Si\n2 1 2\ndirect\n0.788207 0.711794 0.711792 Lu\n0.211793 0.288208 0.288207 Lu\n0.000000 0.000000 0.000000 Al\n0.500000 0.289701 0.710299 Si\n0.500000 0.710301 0.289699 Si\n",
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"spacegroup": 71
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{
"id": "jvasp-8334",
"created_at": "2022-09-04T14:37:06.124322Z",
"updated_at": "2022-09-04T14:37:06.124340Z",
"structure_string": "Ca1 Co2 N2\n1.0\n3.456335 0.000000 0.000000\n0.000000 3.456324 0.000000\n0.000000 0.000000 5.987940\nCa Co N\n1 2 2\ndirect\n0.000000 0.000000 0.250011 Ca\n0.499999 0.499999 0.948686 Co\n0.499999 0.499999 0.551307 Co\n0.499999 0.000000 0.534475 N\n0.000000 0.499999 0.965523 N\n",
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"formula_full": "Ca1 Co2 N2",
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"spacegroup": 115
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{
"id": "jvasp-7922",
"created_at": "2022-09-04T14:37:06.141064Z",
"updated_at": "2022-09-04T14:37:06.141083Z",
"structure_string": "Ba1 Mn2 P2\n1.0\n3.659108 -0.000000 -1.081229\n-0.319492 3.645134 -1.081229\n0.070715 0.077184 6.971531\nBa Mn P\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ba\n0.250000 0.749999 0.500000 Mn\n0.750000 0.249999 0.500000 Mn\n0.653010 0.653009 0.306020 P\n0.346989 0.346989 0.693980 P\n",
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{
"id": "jvasp-50131",
"created_at": "2022-09-04T14:37:06.309069Z",
"updated_at": "2022-09-04T14:37:06.309089Z",
"structure_string": "Ba2 Na4 O4\n1.0\n3.790122 0.000000 0.000000\n-1.895061 7.238825 0.000000\n0.000000 0.000000 6.241157\nBa Na O\n2 4 4\ndirect\n0.197323 0.394646 0.030581 Ba\n0.802676 0.605353 0.530581 Ba\n0.038433 0.076866 0.681447 Na\n0.417867 0.835733 0.868857 Na\n0.961566 0.923134 0.181447 Na\n0.582133 0.164266 0.368857 Na\n0.170137 0.340275 0.447944 O\n0.433932 0.867863 0.486062 O\n0.566068 0.132136 0.986063 O\n0.829863 0.659724 0.947944 O\n",
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{
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"created_at": "2022-09-04T14:37:06.494298Z",
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"structure_string": "Th1 Ge2 Pt2\n1.0\n4.147361 0.000000 -1.659185\n-0.663770 4.093899 -1.659185\n-0.063576 -0.074714 5.854124\nTh Ge Pt\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Th\n0.625928 0.625929 0.251856 Ge\n0.374071 0.374072 0.748142 Ge\n0.250000 0.750001 0.499999 Pt\n0.749999 0.250001 0.499999 Pt\n",
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{
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"structure_string": "Li1 Ni2 S2\n1.0\n3.677628 0.000000 0.000000\n-1.838814 3.184470 -0.000449\n0.000000 0.001057 6.117632\nLi Ni S\n1 2 2\ndirect\n-0.000038 0.000000 0.000000 Li\n0.333280 0.666639 0.369188 Ni\n0.666641 0.333362 0.630811 Ni\n0.333290 0.666659 0.743256 S\n0.666631 0.333342 0.256743 S\n",
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