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{
"id": "jvasp-40336",
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"structure_string": "Li1 Y2 Ir1\n1.0\n-0.000000 3.467330 3.467330\n3.467330 0.000000 3.467330\n3.467330 3.467330 0.000000\nLi Y Ir\n1 2 1\ndirect\n0.750000 0.750000 0.750000 Li\n0.000000 0.000000 0.000000 Y\n0.500000 0.500000 0.500000 Y\n0.250000 0.250000 0.250000 Ir\n",
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{
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"created_at": "2022-09-04T14:38:43.025384Z",
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"structure_string": "Li1 Y1 Ir1\n1.0\n2.851550 -0.000000 -0.000000\n-0.000000 2.851550 -0.000000\n0.000000 0.000000 8.108872\nLi Y Ir\n1 1 1\ndirect\n0.000000 0.000000 -0.079910 Li\n0.000000 0.000000 0.534408 Y\n0.000000 0.000000 0.219344 Ir\n",
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{
"id": "jvasp-116211",
"created_at": "2022-09-04T14:38:30.583057Z",
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"structure_string": "Li1 Y1 Ir1\n1.0\n4.773915 -0.000000 -0.000000\n-2.386957 4.134331 0.000000\n0.000000 -0.000000 2.918012\nLi Y Ir\n1 1 1\ndirect\n0.333334 0.666667 0.000000 Li\n0.666667 0.333334 0.000000 Y\n0.000000 0.000000 0.000000 Ir\n",
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"density_atomic": 0.052089987739455786,
"volume": 57.592641699311386,
"volume_molar": 11.561033168449958,
"formula_full": "Li1 Y1 Ir1",
"formula_reduced": "LiYIr",
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},
{
"id": "jvasp-40631",
"created_at": "2022-09-04T14:37:46.299271Z",
"updated_at": "2022-09-04T14:37:46.299283Z",
"structure_string": "Li1 V1 Ir2\n1.0\n0.000001 2.962010 2.962010\n2.962009 0.000001 2.962010\n2.962009 2.962010 0.000001\nLi V Ir\n1 1 2\ndirect\n0.250000 0.250000 0.250000 Li\n0.749999 0.749999 0.749999 V\n0.000000 0.000000 0.000000 Ir\n0.499999 0.499999 0.499999 Ir\n",
"nsites": 4,
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"elements": [
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"density": 14.131655690681749,
"density_atomic": 0.07696101752527905,
"volume": 51.97436479690692,
"volume_molar": 7.824923517964057,
"formula_full": "Li1 V1 Ir2",
"formula_reduced": "LiVIr2",
"formula_anonymous": "ABC2",
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"spacegroup": 225
},
{
"id": "jvasp-40322",
"created_at": "2022-09-04T14:37:36.288892Z",
"updated_at": "2022-09-04T14:37:36.288911Z",
"structure_string": "Li1 Tm2 Ir1\n1.0\n0.000000 3.406087 3.406087\n3.406087 0.000000 3.406087\n3.406087 3.406087 0.000000\nLi Tm Ir\n1 2 1\ndirect\n0.750001 0.750001 0.750001 Li\n0.000000 0.000000 0.000000 Tm\n0.500000 0.500000 0.500000 Tm\n0.249999 0.249999 0.249999 Ir\n",
"nsites": 4,
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"elements": [
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"density": 11.283596403381598,
"density_atomic": 0.050613082197092846,
"volume": 79.0309506230734,
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"formula_full": "Li1 Tm2 Ir1",
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},
{
"id": "jvasp-76997",
"created_at": "2022-09-04T14:38:11.615402Z",
"updated_at": "2022-09-04T14:38:11.615429Z",
"structure_string": "Li1 Ti2 Ir1\n1.0\n-11.476437 0.002283 -6.627789\n-6.843573 -0.378765 -1.400467\n-5.926944 2.211153 -2.985911\nLi Ti Ir\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Li\n0.682129 0.000074 0.999923 Ti\n0.317872 0.999924 0.000076 Ti\n0.500000 0.000000 -0.000001 Ir\n",
"nsites": 4,
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"elements": [
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"formula_full": "Li1 Ti2 Ir1",
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"spacegroup": 139
},
{
"id": "jvasp-81386",
"created_at": "2022-09-04T14:37:18.576261Z",
"updated_at": "2022-09-04T14:37:18.576288Z",
"structure_string": "Li1 Ti2 Ir1\n1.0\n-8.595185 -0.000000 -4.962433\n-5.518962 -1.055358 -0.365741\n-4.207215 2.654823 -2.637754\nLi Ti Ir\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Li\n0.746497 0.000000 0.000000 Ti\n0.253503 0.000000 0.000000 Ti\n0.500000 0.000000 0.000000 Ir\n",
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"formula_full": "Li1 Ti2 Ir1",
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},
{
"id": "jvasp-107947",
"created_at": "2022-09-04T14:35:57.627251Z",
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"structure_string": "Li1 Ti2 Ir1\n1.0\n3.789873 -0.000000 2.188084\n1.263291 3.573126 2.188084\n-0.000000 -0.000000 4.376168\nLi Ti Ir\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Li\n0.250000 0.250000 0.250000 Ti\n0.749999 0.750001 0.749999 Ti\n0.499999 0.500001 0.499999 Ir\n",
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{
"id": "jvasp-41178",
"created_at": "2022-09-04T14:37:44.196889Z",
"updated_at": "2022-09-04T14:37:44.196925Z",
"structure_string": "Li1 Ti1 Ir2\n1.0\n-0.000000 3.014319 3.014319\n3.014319 0.000000 3.014319\n3.014319 3.014319 0.000000\nLi Ti Ir\n1 1 2\ndirect\n0.250000 0.250000 0.250000 Li\n0.749999 0.749999 0.749999 Ti\n0.000000 0.000000 0.000000 Ir\n0.499999 0.499999 0.499999 Ir\n",
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"formula_full": "Li1 Ti1 Ir2",
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{
"id": "jvasp-40384",
"created_at": "2022-09-04T14:38:29.082581Z",
"updated_at": "2022-09-04T14:38:29.082609Z",
"structure_string": "Li1 Tb2 Ir1\n1.0\n-0.000006 3.470806 3.470806\n3.470806 -0.000006 3.470806\n3.470806 3.470806 -0.000006\nTb Li Ir\n2 1 1\ndirect\n-0.000004 -0.000004 -0.000004 Tb\n0.500004 0.500004 0.500004 Tb\n0.750000 0.750000 0.750000 Li\n0.250001 0.250001 0.250001 Ir\n",
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},
{
"id": "jvasp-38869",
"created_at": "2022-09-04T14:37:56.887663Z",
"updated_at": "2022-09-04T14:37:56.887696Z",
"structure_string": "Li1 Ta1 Ir2\n1.0\n-0.000000 3.078569 3.078569\n3.078569 0.000000 3.078569\n3.078569 3.078569 0.000000\nLi Ta Ir\n1 1 2\ndirect\n0.249999 0.249999 0.249999 Li\n0.750000 0.750000 0.750000 Ta\n0.000000 0.000000 0.000000 Ir\n0.500000 0.500000 0.500000 Ir\n",
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{
"id": "jvasp-81014",
"created_at": "2022-09-04T14:37:09.000379Z",
"updated_at": "2022-09-04T14:37:09.000400Z",
"structure_string": "Sr2 Li1 Ir1\n1.0\n-15.249236 -0.000002 -8.804152\n-8.903466 -0.439784 -2.187048\n-7.843585 2.558011 -4.022815\nSr Li Ir\n2 1 1\ndirect\n0.654372 0.000001 0.000001 Sr\n0.345628 0.000000 0.000000 Sr\n0.000000 0.000000 0.000000 Li\n0.500000 0.000001 0.000000 Ir\n",
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