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{
"id": "jvasp-110175",
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"structure_string": "Sm2 Ge2 Pd2\n1.0\n4.464269 0.010875 3.540284\n2.272865 3.842382 3.540284\n-0.002581 -0.001476 7.232571\nSm Ge Pd\n2 2 2\ndirect\n0.544519 0.544517 0.694447 Sm\n0.455483 0.455482 0.305551 Sm\n0.841356 0.841356 0.100997 Ge\n0.158645 0.158644 0.899001 Ge\n0.178070 0.178070 0.276686 Pd\n0.821931 0.821930 0.723312 Pd\n",
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{
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"structure_string": "Mg1 Ag5\n1.0\n4.513140 -0.003104 3.315472\n1.676621 4.190153 3.315472\n-0.004589 -0.003104 5.600069\nMg Ag\n1 5\ndirect\n0.500000 0.500001 0.500000 Mg\n-0.000000 0.667566 0.332434 Ag\n0.667566 0.332435 -0.000001 Ag\n0.332434 0.000001 0.667566 Ag\n0.832518 0.832520 0.832518 Ag\n0.167481 0.167481 0.167481 Ag\n",
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{
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"created_at": "2022-09-04T14:36:57.544642Z",
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"structure_string": "Sm1 Ga2 Pd2\n1.0\n3.988940 -0.000000 -1.497173\n-0.561935 3.949161 -1.497173\n-0.017108 -0.019714 6.016901\nSm Ga Pd\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Sm\n0.620612 0.620613 0.241227 Ga\n0.379386 0.379388 0.758773 Ga\n0.249999 0.750000 0.500000 Pd\n0.749999 0.250001 0.500000 Pd\n",
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"volume": 94.5485658903806,
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"formula_full": "Sm1 Ga2 Pd2",
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"formula_anonymous": "AB2C2",
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{
"id": "jvasp-120467",
"created_at": "2022-09-04T14:38:52.073244Z",
"updated_at": "2022-09-04T14:38:52.073267Z",
"structure_string": "Tb12 Co4 Sn2\n1.0\n7.881395 0.002854 -2.768125\n-3.681920 6.800744 -3.157890\n0.000134 -0.002854 8.353377\nTb Co Sn\n12 4 2\ndirect\n0.442771 0.235857 0.206914 Tb\n0.676117 0.989358 0.313240 Tb\n0.323882 0.010642 0.686759 Tb\n0.676118 0.362877 0.686759 Tb\n0.815706 0.285029 0.100735 Tb\n0.184294 0.714971 0.899265 Tb\n0.323882 0.637123 0.313241 Tb\n0.184294 0.285030 0.469324 Tb\n0.971057 0.764142 0.206913 Tb\n0.028943 0.235857 0.793086 Tb\n0.557229 0.764143 0.793086 Tb\n0.815706 0.714970 0.530676 Tb\n0.342831 -0.000000 0.342831 Co\n0.657169 -0.000000 0.657169 Co\n0.113075 0.613075 0.500000 Co\n0.886925 0.386924 0.500000 Co\n0.500000 0.499999 -0.000001 Sn\n0.000000 0.000000 0.000000 Sn\n",
"nsites": 18,
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"elements": [
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],
"chemical_system": "Co-Sn-Tb",
"density": 8.82797036484291,
"density_atomic": 0.04020318189551801,
"volume": 447.7257558065746,
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"formula_full": "Tb12 Co4 Sn2",
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"formula_anonymous": "AB2C6",
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"spacegroup": 71
},
{
"id": "jvasp-79979",
"created_at": "2022-09-04T14:37:18.719543Z",
"updated_at": "2022-09-04T14:37:18.719571Z",
"structure_string": "Y2 Cu1 Ir1\n1.0\n-0.000000 3.441858 3.441858\n3.441858 0.000000 3.441858\n3.441858 3.441858 0.000000\nY Cu Ir\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Y\n0.500000 0.500000 0.500000 Y\n0.250001 0.250001 0.250001 Cu\n0.750001 0.750001 0.750001 Ir\n",
"nsites": 4,
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{
"id": "jvasp-35101",
"created_at": "2022-09-04T14:37:39.571930Z",
"updated_at": "2022-09-04T14:37:39.571960Z",
"structure_string": "Th2 Sb2 Se2\n1.0\n4.300948 0.000000 0.000000\n0.000000 4.300948 -0.000000\n0.000000 -0.000000 8.799839\nTh Sb Se\n2 2 2\ndirect\n0.500000 0.000000 0.713515 Th\n0.000000 0.500000 0.286485 Th\n0.500000 0.500000 0.000000 Sb\n0.000000 0.000000 0.000000 Sb\n0.500000 0.000000 0.367763 Se\n0.000000 0.500000 0.632237 Se\n",
"nsites": 6,
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"Sb",
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"formula_full": "Th2 Sb2 Se2",
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{
"id": "jvasp-40632",
"created_at": "2022-09-04T14:37:55.057934Z",
"updated_at": "2022-09-04T14:37:55.057949Z",
"structure_string": "Sc1 Ga1 Rh2\n1.0\n0.000018 3.112002 3.111975\n3.111965 0.000025 3.111967\n3.111983 3.112013 0.000007\nSc Ga Rh\n1 1 2\ndirect\n0.750001 0.750001 0.749998 Sc\n0.250000 0.250000 0.249999 Ga\n0.000002 0.999998 0.000000 Rh\n0.500002 0.500000 0.499997 Rh\n",
"nsites": 4,
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"formula_full": "Sc1 Ga1 Rh2",
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"formula_anonymous": "ABC2",
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"spacegroup": 225
},
{
"id": "jvasp-111729",
"created_at": "2022-09-04T14:38:53.544416Z",
"updated_at": "2022-09-04T14:38:53.544438Z",
"structure_string": "Tb1 Ga4 Co8\n1.0\n6.318598 -0.002371 -0.946995\n-4.687549 4.236928 -0.946995\n0.000913 0.002371 6.389168\nTb Ga Co\n1 4 8\ndirect\n0.000000 0.000000 0.000000 Tb\n0.343295 0.000000 0.343295 Ga\n0.656705 0.000000 0.656705 Ga\n-0.000000 0.343295 0.343295 Ga\n-0.000000 0.656705 0.656705 Ga\n0.275522 0.500000 0.775522 Co\n0.724478 0.500000 0.224477 Co\n0.500000 0.275522 0.775522 Co\n0.500000 0.724478 0.224477 Co\n0.500000 0.500000 0.499999 Co\n-0.000000 -0.000000 0.500000 Co\n0.000000 0.500000 -0.000000 Co\n0.500000 0.000000 -0.000000 Co\n",
"nsites": 13,
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"formula_full": "Tb1 Ga4 Co8",
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{
"id": "jvasp-93796",
"created_at": "2022-09-04T14:36:05.737812Z",
"updated_at": "2022-09-04T14:36:05.737844Z",
"structure_string": "Pr1 Cd1 Ni4\n1.0\n-3.580339 -3.580339 0.000000\n-3.580339 0.000000 -3.580339\n0.000000 -3.580339 -3.580339\nPr Cd Ni\n1 1 4\ndirect\n0.750000 0.750000 0.750000 Pr\n0.000000 0.000000 0.000000 Cd\n0.879324 0.373559 0.373559 Ni\n0.373559 0.879324 0.373559 Ni\n0.373559 0.373559 0.879324 Ni\n0.373559 0.373559 0.373559 Ni\n",
"nsites": 6,
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},
{
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"created_at": "2022-09-04T14:37:02.567018Z",
"updated_at": "2022-09-04T14:37:02.567047Z",
"structure_string": "Ti1 Cr1 Tc2\n1.0\n3.711033 0.000000 2.142566\n1.237011 3.498795 2.142566\n0.000000 0.000000 4.285132\nTi Cr Tc\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Ti\n0.499999 0.500001 0.500001 Cr\n0.250000 0.250000 0.250000 Tc\n0.749999 0.750001 0.750001 Tc\n",
"nsites": 4,
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},
{
"id": "jvasp-107662",
"created_at": "2022-09-04T14:36:58.269974Z",
"updated_at": "2022-09-04T14:36:58.269994Z",
"structure_string": "K1 Hg3\n1.0\n4.801522 -0.000000 2.772160\n1.600507 4.526918 2.772160\n-0.000000 -0.000000 5.544320\nK Hg\n1 3\ndirect\n0.000000 0.000000 0.000000 K\n0.250000 0.250000 0.250000 Hg\n0.750000 0.750000 0.750000 Hg\n0.500000 0.500000 0.500000 Hg\n",
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{
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"created_at": "2022-09-04T14:38:42.474019Z",
"updated_at": "2022-09-04T14:38:42.474046Z",
"structure_string": "Ho4 Ga12 Pt1\n1.0\n7.022179 -0.000000 -2.482715\n-3.511089 6.081385 -2.482715\n-0.000000 -0.000000 7.448145\nHo Ga Pt\n4 12 1\ndirect\n0.500000 0.500000 0.500000 Ho\n0.000000 0.000000 0.500000 Ho\n0.000000 0.500000 -0.000000 Ho\n0.500000 0.000000 -0.000000 Ho\n0.750000 0.250000 0.500000 Ga\n0.750000 0.500000 0.250000 Ga\n0.250000 0.500000 0.750000 Ga\n0.500000 0.250000 0.750000 Ga\n0.500000 0.750001 0.250000 Ga\n0.297528 0.297528 -0.000000 Ga\n0.250000 0.750001 0.500000 Ga\n0.702472 0.000000 0.702472 Ga\n0.297528 0.000000 0.297528 Ga\n0.000000 0.702472 0.702472 Ga\n0.000000 0.297528 0.297528 Ga\n0.702472 0.702472 -0.000001 Ga\n0.000000 0.000000 0.000000 Pt\n",
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