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{
"id": "jvasp-78552",
"created_at": "2022-09-04T14:36:33.631779Z",
"updated_at": "2022-09-04T14:36:33.631797Z",
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{
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"structure_string": "Cu1 Br1\n1.0\n3.964144 -0.329916 0.571433\n-1.632429 3.627458 -0.571433\n-0.699284 -1.978687 3.427187\nCu Br\n1 1\ndirect\n0.749999 0.499999 0.250000 Cu\n0.000000 0.000000 0.000000 Br\n",
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{
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"created_at": "2022-09-04T14:36:18.268302Z",
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"structure_string": "Tb4 Pd4\n1.0\n0.000000 4.580386 0.000000\n0.000000 -0.000000 5.568000\n6.997422 0.000000 0.000000\nTb Pd\n4 4\ndirect\n0.250000 0.355670 0.683150 Tb\n0.250000 0.144330 0.183150 Tb\n0.750001 0.644330 0.316850 Tb\n0.750001 0.855670 0.816849 Tb\n0.250000 0.843754 0.542849 Pd\n0.250000 0.656246 0.042849 Pd\n0.750001 0.156246 0.457151 Pd\n0.750001 0.343754 0.957151 Pd\n",
"nsites": 8,
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"elements": [
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{
"id": "jvasp-87088",
"created_at": "2022-09-04T14:36:19.190948Z",
"updated_at": "2022-09-04T14:36:19.190977Z",
"structure_string": "Hg4 Pd4\n1.0\n5.304728 -0.000000 0.000000\n0.000000 5.304728 0.000000\n0.000000 0.000000 5.304728\nHg Pd\n4 4\ndirect\n0.843257 0.656744 0.343257 Hg\n0.656744 0.343257 0.843257 Hg\n0.343257 0.843257 0.656744 Hg\n0.156743 0.156743 0.156743 Hg\n0.152814 0.347187 0.652814 Pd\n0.347187 0.652814 0.152814 Pd\n0.652814 0.152814 0.347187 Pd\n0.847187 0.847187 0.847187 Pd\n",
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"elements": [
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"density": 13.660677836821002,
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"volume": 149.27578409403523,
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"formula_full": "Hg4 Pd4",
"formula_reduced": "HgPd",
"formula_anonymous": "AB",
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"spacegroup": 198
},
{
"id": "jvasp-15997",
"created_at": "2022-09-04T14:36:35.067249Z",
"updated_at": "2022-09-04T14:36:35.067279Z",
"structure_string": "Re4 Si4\n1.0\n4.827012 -0.000000 -0.000000\n-0.000000 4.827012 -0.000000\n0.000000 -0.000000 4.827012\nRe Si\n4 4\ndirect\n0.867313 0.632687 0.367313 Re\n0.632687 0.367313 0.867313 Re\n0.367313 0.867313 0.632687 Re\n0.132687 0.132687 0.132687 Re\n0.156324 0.343675 0.656324 Si\n0.343675 0.656324 0.156324 Si\n0.656324 0.156324 0.343675 Si\n0.843675 0.843675 0.843675 Si\n",
"nsites": 8,
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"elements": [
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},
{
"id": "jvasp-100336",
"created_at": "2022-09-04T14:36:35.883554Z",
"updated_at": "2022-09-04T14:36:35.883570Z",
"structure_string": "Tc1 Ir1\n1.0\n2.757451 -0.000000 -0.000000\n-1.378725 2.388024 -0.000000\n0.000000 0.000000 4.387477\nTc Ir\n1 1\ndirect\n0.666666 0.333332 0.000000 Tc\n0.000000 0.000000 0.500000 Ir\n",
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"elements": [
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{
"id": "jvasp-78947",
"created_at": "2022-09-04T14:36:36.729764Z",
"updated_at": "2022-09-04T14:36:36.729788Z",
"structure_string": "Pb2 O2\n1.0\n3.388441 1.043958 -0.574937\n0.935094 3.427261 0.530655\n-0.934614 0.979422 7.495170\nPb O\n2 2\ndirect\n0.047042 0.118610 0.964311 Pb\n0.881412 0.952861 0.464312 Pb\n0.036330 0.464772 0.285689 O\n0.535215 0.963755 0.785690 O\n",
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{
"id": "jvasp-101000",
"created_at": "2022-09-04T14:36:36.739354Z",
"updated_at": "2022-09-04T14:36:36.739373Z",
"structure_string": "Mg2 Ge2\n1.0\n5.680706 0.069162 1.602349\n4.707774 3.179947 1.602349\n0.051358 0.016063 4.501190\nMg Ge\n2 2\ndirect\n0.141510 0.141508 0.754637 Mg\n0.858491 0.858491 0.245364 Mg\n0.397162 0.397160 0.719801 Ge\n0.602839 0.602839 0.280199 Ge\n",
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{
"id": "jvasp-78562",
"created_at": "2022-09-04T14:36:35.034153Z",
"updated_at": "2022-09-04T14:36:35.034172Z",
"structure_string": "Li1 Mg1\n1.0\n3.420218 -0.000000 0.000000\n-0.000000 3.420218 -0.000000\n-0.000000 -0.000000 3.420218\nLi Mg\n1 1\ndirect\n0.000000 0.000000 0.000000 Li\n0.500000 0.500000 0.500000 Mg\n",
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"elements": [
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"density": 1.296827349695291,
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"formula_full": "Li1 Mg1",
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{
"id": "jvasp-14269",
"created_at": "2022-09-04T14:36:33.866615Z",
"updated_at": "2022-09-04T14:36:33.866631Z",
"structure_string": "Yb2 Si2\n1.0\n3.876533 -0.000000 0.000000\n-0.000000 4.180944 -1.694275\n-0.000000 -0.097518 5.765127\nYb Si\n2 2\ndirect\n0.250000 0.860942 0.721886 Yb\n0.749999 0.139057 0.278113 Yb\n0.250000 0.570912 0.141825 Si\n0.749999 0.429086 0.858174 Si\n",
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},
{
"id": "jvasp-7565",
"created_at": "2022-09-04T14:36:32.224264Z",
"updated_at": "2022-09-04T14:36:32.224274Z",
"structure_string": "H1 S1\n1.0\n20.000000 0.000000 0.000000\n0.000000 20.000000 0.000000\n0.000000 0.000000 21.344413\nH S\n1 1\ndirect\n0.500000 0.500000 0.468363 H\n0.500000 0.500000 0.531637 S\n",
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{
"id": "jvasp-15016",
"created_at": "2022-09-04T14:36:39.721388Z",
"updated_at": "2022-09-04T14:36:39.721413Z",
"structure_string": "Hg2 Pd2\n1.0\n3.814770 0.000000 -0.000000\n0.000000 4.347118 0.000000\n0.000000 0.000000 4.347118\nHg Pd\n2 2\ndirect\n0.000000 0.000000 0.000000 Hg\n0.000000 0.500000 0.500000 Hg\n0.500000 0.000000 0.500000 Pd\n0.500000 0.500000 0.000000 Pd\n",
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