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{
"id": "jvasp-16336",
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"volume": 46.89512003046012,
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{
"id": "jvasp-37034",
"created_at": "2022-09-04T14:35:53.656759Z",
"updated_at": "2022-09-04T14:35:53.656770Z",
"structure_string": "Ti1 Fe1 Co1 Sb1\n1.0\n3.037963 3.037963 0.000000\n3.037963 -0.000000 -3.037963\n0.000000 3.037963 -3.037963\nTi Fe Co Sb\n1 1 1 1\ndirect\n0.500000 0.500000 0.500000 Ti\n0.749999 0.749999 0.749999 Fe\n0.250000 0.250000 0.250000 Co\n0.000000 0.000000 0.000000 Sb\n",
"nsites": 4,
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],
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"volume": 56.076052832386026,
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"formula_full": "Ti1 Fe1 Co1 Sb1",
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"spacegroup": 216
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{
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"created_at": "2022-09-04T14:37:31.786123Z",
"updated_at": "2022-09-04T14:37:31.786148Z",
"structure_string": "Ti1 Fe1 Co1 Ge1\n1.0\n2.904948 2.904948 0.000000\n2.904948 0.000000 -2.904948\n-0.000000 2.904948 -2.904948\nTi Fe Co Ge\n1 1 1 1\ndirect\n0.500000 0.500000 0.500000 Ti\n0.750000 0.750000 0.750000 Fe\n0.250000 0.250000 0.250000 Co\n0.000000 0.000000 0.000000 Ge\n",
"nsites": 4,
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"formula_full": "Ti1 Fe1 Co1 Ge1",
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{
"id": "jvasp-37035",
"created_at": "2022-09-04T14:35:46.096094Z",
"updated_at": "2022-09-04T14:35:46.096120Z",
"structure_string": "Ti1 Fe1 Co1 As1\n1.0\n2.920865 2.920865 -0.000000\n2.920865 0.000000 -2.920865\n-0.000000 2.920865 -2.920865\nTi Fe Co As\n1 1 1 1\ndirect\n0.500001 0.500001 0.500001 Ti\n0.750001 0.750001 0.750001 Fe\n0.250000 0.250000 0.250000 Co\n0.000000 0.000000 0.000000 As\n",
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{
"id": "jvasp-57577",
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"structure_string": "Ti1 Fe1 Bi2 O6\n1.0\n5.652234 -0.000286 -0.002948\n-2.825352 4.895353 0.002848\n-2.823612 -1.633334 4.610482\nTi Fe Bi O\n1 1 2 6\ndirect\n0.456877 0.728413 0.185293 Ti\n0.460337 0.230146 0.690449 Fe\n0.006757 0.503345 0.510107 Bi\n0.003740 0.001833 0.005623 Bi\n0.492434 0.932789 0.883917 O\n0.345728 0.457912 0.381298 O\n0.951112 0.559665 0.883989 O\n0.324238 0.391427 0.883926 O\n0.493383 0.035618 0.381214 O\n0.923392 0.887851 0.381181 O\n",
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{
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"structure_string": "Ti1 Fe1\n1.0\n2.945125 -0.000000 -0.000000\n0.000000 2.945125 0.000000\n-0.000000 0.000000 2.945125\nTi Fe\n1 1\ndirect\n0.000000 0.000000 0.000000 Ti\n0.499999 0.499999 0.499999 Fe\n",
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{
"id": "jvasp-78412",
"created_at": "2022-09-04T14:37:15.403447Z",
"updated_at": "2022-09-04T14:37:15.403472Z",
"structure_string": "Ti1 Fe1\n1.0\n2.945086 0.000000 0.000000\n-0.000000 2.945086 0.000000\n-0.000000 0.000000 2.945086\nTi Fe\n1 1\ndirect\n0.500001 0.500001 0.500001 Ti\n0.000000 0.000000 0.000000 Fe\n",
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},
{
"id": "jvasp-79250",
"created_at": "2022-09-04T14:36:37.571879Z",
"updated_at": "2022-09-04T14:36:37.571902Z",
"structure_string": "Ti1 F3\n1.0\n3.934973 -0.033126 0.034981\n0.034375 3.934962 0.034981\n-0.033699 -0.033126 3.934984\nTi F\n1 3\ndirect\n0.000000 0.000000 0.000000 Ti\n0.000001 0.500000 -0.000000 F\n-0.000000 -0.000000 0.499999 F\n0.500000 -0.000000 -0.000000 F\n",
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},
{
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"structure_string": "Ti1 F3\n1.0\n2.905245 3.584204 3.697488\n-0.661815 2.423004 2.453753\n-1.493611 -4.181385 0.499545\nTi F\n1 3\ndirect\n0.000000 0.000000 0.000000 Ti\n0.499999 0.500000 0.500001 F\n-0.000001 0.499999 0.500000 F\n0.499999 0.500001 0.000001 F\n",
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{
"id": "jvasp-8025",
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"structure_string": "Ti1 F2\n1.0\n3.155687 0.000000 1.821936\n1.051896 2.975210 1.821936\n0.000000 0.000000 3.643874\nTi F\n1 2\ndirect\n0.000000 0.000000 0.000000 Ti\n0.750002 0.750000 0.750000 F\n0.250001 0.250000 0.250000 F\n",
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