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{
"id": "jvasp-69372",
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"updated_at": "2022-09-04T14:35:58.167195Z",
"structure_string": "Ba1 P2 Pb1\n1.0\n4.318493 0.000000 0.000000\n0.000000 4.318216 0.000000\n0.000000 0.000000 6.703128\nBa P Pb\n1 2 1\ndirect\n0.500000 0.500001 0.847075 Ba\n0.000000 0.000000 0.948976 P\n0.500000 0.500001 0.361948 P\n0.000000 0.000000 0.342001 Pb\n",
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{
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"created_at": "2022-09-04T14:36:12.270089Z",
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"structure_string": "Ba1 P2 Pb1\n1.0\n4.317893 0.000000 -0.000000\n0.000000 4.317893 0.000000\n-0.000000 0.000000 6.703845\nBa P Pb\n1 2 1\ndirect\n0.500000 0.500000 0.847111 Ba\n0.000000 0.000000 0.948915 P\n0.500000 0.500000 0.361941 P\n0.000000 0.000000 0.342034 Pb\n",
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{
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"structure_string": "Ba1 P2 Pd2\n1.0\n4.299986 0.000000 -0.000000\n0.000000 4.299986 0.000000\n0.000000 0.000000 5.698306\nBa P Pd\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ba\n0.500000 0.500000 0.715257 P\n0.500000 0.500000 0.284744 P\n0.500000 0.000000 0.500000 Pd\n0.000000 0.500000 0.500000 Pd\n",
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"volume": 105.36099186507445,
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"formula_full": "Ba1 P2 Pd2",
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{
"id": "jvasp-16071",
"created_at": "2022-09-04T14:36:49.487612Z",
"updated_at": "2022-09-04T14:36:49.487622Z",
"structure_string": "Ba1 P2 Rh2\n1.0\n3.817350 -0.000000 -1.140994\n-0.341040 3.802085 -1.140994\n-0.002703 -0.002956 6.947179\nBa P Rh\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ba\n0.648832 0.648832 0.297664 P\n0.351169 0.351168 0.702338 P\n0.250000 0.750000 0.500001 Rh\n0.750000 0.250000 0.500001 Rh\n",
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{
"id": "jvasp-65718",
"created_at": "2022-09-04T14:36:07.317472Z",
"updated_at": "2022-09-04T14:36:07.317506Z",
"structure_string": "Ba1 P2 Ru1\n1.0\n5.063659 0.000000 0.000000\n0.000000 5.063659 0.000000\n0.000000 0.000000 3.238624\nBa P Ru\n1 2 1\ndirect\n0.000000 -0.000000 0.499999 Ba\n0.500000 0.000000 0.000000 P\n0.000000 0.500000 -0.000000 P\n0.500000 0.500000 0.499999 Ru\n",
"nsites": 4,
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"elements": [
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{
"id": "jvasp-15394",
"created_at": "2022-09-04T14:36:02.914618Z",
"updated_at": "2022-09-04T14:36:02.914643Z",
"structure_string": "Ba1 P2 Ru2\n1.0\n3.878054 -0.000000 -1.228452\n-0.389137 3.858481 -1.228452\n0.002445 0.002705 6.743188\nBa P Ru\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ba\n0.655608 0.655608 0.311219 P\n0.344391 0.344390 0.688781 P\n0.250000 0.749999 0.500000 Ru\n0.750000 0.249999 0.500000 Ru\n",
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"formula_full": "Ba1 P2 Ru2",
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{
"id": "jvasp-8678",
"created_at": "2022-09-04T14:37:11.970437Z",
"updated_at": "2022-09-04T14:37:11.970457Z",
"structure_string": "Ba1 P4 Pd2\n1.0\n5.507596 0.023086 -1.582196\n-3.119035 4.539357 -1.582196\n-0.012086 -0.023086 5.730341\nBa P Pd\n1 4 2\ndirect\n0.000000 0.000000 0.000000 Ba\n0.500000 0.272342 0.772341 P\n0.272342 0.500000 0.772341 P\n0.727659 0.500001 0.227658 P\n0.500001 0.727659 0.227657 P\n0.750001 0.250000 0.500000 Pd\n0.250001 0.750000 0.499999 Pd\n",
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{
"id": "jvasp-16063",
"created_at": "2022-09-04T14:37:00.275503Z",
"updated_at": "2022-09-04T14:37:00.275521Z",
"structure_string": "Ba1 Pa1 O3\n1.0\n4.493315 0.000000 -0.000000\n-0.000000 4.493315 -0.000000\n0.000000 0.000000 4.493315\nBa Pa O\n1 1 3\ndirect\n0.500001 0.500001 0.500001 Ba\n0.000000 0.000000 0.000000 Pa\n0.000000 0.500001 0.000000 O\n0.000000 0.000000 0.500001 O\n0.500001 0.000000 0.000000 O\n",
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},
{
"id": "jvasp-64069",
"created_at": "2022-09-04T14:36:07.374447Z",
"updated_at": "2022-09-04T14:36:07.374477Z",
"structure_string": "Ba1 Pb1 Br1\n1.0\n0.000000 4.100059 4.100059\n4.100059 -0.000000 4.100059\n4.100059 4.100059 -0.000000\nBa Pb Br\n1 1 1\ndirect\n0.750000 0.750000 0.750000 Ba\n0.500000 0.500000 0.500000 Pb\n0.000000 0.000000 0.000000 Br\n",
"nsites": 3,
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{
"id": "jvasp-66296",
"created_at": "2022-09-04T14:35:51.675194Z",
"updated_at": "2022-09-04T14:35:51.675214Z",
"structure_string": "Ba1 Pb1 Cl1\n1.0\n-0.000000 4.033176 4.033176\n4.033176 -0.000000 4.033176\n4.033176 4.033176 0.000000\nBa Pb Cl\n1 1 1\ndirect\n0.750001 0.750001 0.750001 Ba\n0.500000 0.500000 0.500000 Pb\n0.000000 0.000000 0.000000 Cl\n",
"nsites": 3,
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{
"id": "jvasp-120855",
"created_at": "2022-09-04T14:38:52.391650Z",
"updated_at": "2022-09-04T14:38:52.391677Z",
"structure_string": "Ba1 Pb1 Cl2\n1.0\n4.322861 0.000000 -0.000000\n0.000000 4.322861 0.000000\n0.000000 -0.000000 6.983806\nBa Pb Cl\n1 1 2\ndirect\n0.500000 0.500000 0.548196 Ba\n0.000000 0.000000 0.884817 Pb\n0.000000 0.000000 0.450390 Cl\n0.500000 0.500000 0.126598 Cl\n",
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{
"id": "jvasp-117595",
"created_at": "2022-09-04T14:38:51.404255Z",
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"structure_string": "Ba1 Pb1 F1\n1.0\n3.679704 -0.000000 -0.000000\n-0.000000 3.679704 0.000000\n-0.000000 -0.000000 8.265698\nBa Pb F\n1 1 1\ndirect\n0.000000 0.000000 0.002390 Ba\n0.000000 0.000000 0.573055 Pb\n0.000000 0.000000 0.289233 F\n",
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