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{
"id": "jvasp-35691",
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"structure_string": "Sr2 S1 O1\n1.0\n4.018134 0.000000 -0.000000\n-0.000000 4.018134 0.000000\n-0.000000 -0.000000 5.688829\nSr S O\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Sr\n0.500000 0.500000 0.500000 Sr\n0.000000 0.000000 0.500000 S\n0.500000 0.500000 0.000000 O\n",
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{
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"structure_string": "Sr2 Ru2 O6\n1.0\n4.802289 -0.000000 -2.769522\n-1.597207 4.528897 -2.769522\n0.031717 0.044818 5.603288\nSr Ru O\n2 2 6\ndirect\n0.250000 0.750001 0.500001 Sr\n0.750000 0.250000 0.500001 Sr\n0.000000 0.000000 0.000000 Ru\n0.500000 0.500000 0.000001 Ru\n0.797558 0.297559 0.000001 O\n0.702441 0.797559 0.000001 O\n0.297558 0.202442 0.000000 O\n0.202441 0.702442 0.000001 O\n0.250000 0.250000 0.500001 O\n0.750000 0.750001 0.500001 O\n",
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{
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"structure_string": "Sr2 Ru1 O4\n1.0\n3.718801 -0.000000 -1.084098\n-0.316034 3.705348 -1.084098\n0.019294 0.021009 6.986567\nSr Ru O\n2 1 4\ndirect\n0.352672 0.352673 0.705345 Sr\n0.647328 0.647328 0.294655 Sr\n0.000000 0.000000 0.000000 Ru\n0.837346 0.837346 0.674691 O\n0.162654 0.162654 0.325309 O\n0.000001 0.500000 -0.000000 O\n0.500000 0.000000 -0.000000 O\n",
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"formula_full": "Sr2 Ru1 O4",
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{
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"created_at": "2022-09-04T14:36:59.088938Z",
"updated_at": "2022-09-04T14:36:59.088954Z",
"structure_string": "Sr2 Ru1 N2\n1.0\n3.732748 -0.000000 -1.101736\n-0.326747 3.717408 -1.107039\n0.004169 0.013815 6.888381\nSr Ru N\n2 1 2\ndirect\n0.142674 0.142675 0.785349 Sr\n0.857326 0.857327 0.214650 Sr\n0.500000 0.500001 0.500000 Ru\n0.644943 0.644944 0.789885 N\n0.355057 0.355057 0.210115 N\n",
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"formula_full": "Sr2 Ru1 N2",
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},
{
"id": "jvasp-19669",
"created_at": "2022-09-04T14:38:15.213113Z",
"updated_at": "2022-09-04T14:38:15.213148Z",
"structure_string": "Sr2 Rh4\n1.0\n4.737904 -0.000000 2.735431\n1.579301 4.466939 2.735431\n-0.000000 -0.000000 5.470861\nSr Rh\n2 4\ndirect\n0.125000 0.125000 0.125000 Sr\n0.874999 0.875000 0.875000 Sr\n-0.000000 0.500000 0.500000 Rh\n0.500000 0.000000 0.500000 Rh\n0.499999 0.500000 0.000000 Rh\n0.499999 0.500000 0.500000 Rh\n",
"nsites": 6,
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"elements": [
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"volume": 115.78490915467452,
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{
"id": "jvasp-101654",
"created_at": "2022-09-04T14:36:52.543555Z",
"updated_at": "2022-09-04T14:36:52.543577Z",
"structure_string": "Sr2 Rh2 O6\n1.0\n4.815988 0.013027 -2.898210\n-1.532782 4.565577 -2.898210\n-0.009341 -0.013027 5.620789\nSr Rh O\n2 2 6\ndirect\n0.750001 0.250000 0.500001 Sr\n0.250001 0.750000 0.500001 Sr\n0.000000 0.000000 0.000000 Rh\n0.500001 0.500001 0.000001 Rh\n0.690178 0.190178 0.880357 O\n0.309823 0.809823 0.119644 O\n0.190178 0.309822 0.500000 O\n0.809823 0.690179 0.500001 O\n0.250000 0.250000 0.000000 O\n0.750001 0.750001 0.000001 O\n",
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"volume": 123.33787052455665,
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"formula_full": "Sr2 Rh2 O6",
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"formula_anonymous": "ABC3",
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{
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"created_at": "2022-09-04T14:36:54.081899Z",
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"structure_string": "Sr2 Rh2 O6\n1.0\n4.887844 -0.002733 -2.701428\n-1.625512 4.521074 -2.847163\n0.015980 0.002733 5.584664\nSr Rh O\n2 2 6\ndirect\n0.256570 0.749999 0.506570 Sr\n0.743429 0.250000 0.493429 Sr\n0.500000 0.500000 -0.000000 Rh\n0.000000 0.000000 0.000000 Rh\n0.297257 0.297257 0.499999 O\n0.702742 0.702742 0.499999 O\n0.702742 0.202743 -0.000000 O\n0.297258 0.797257 0.000000 O\n0.831579 0.750000 0.081580 O\n0.168420 0.249999 0.918419 O\n",
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"volume": 123.63212386992477,
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"formula_full": "Sr2 Rh2 O6",
"formula_reduced": "SrRhO3",
"formula_anonymous": "ABC3",
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"created_at": "2022-09-04T14:35:52.887416Z",
"updated_at": "2022-09-04T14:35:52.887450Z",
"structure_string": "Sr2 Rh1 O4\n1.0\n3.911005 -0.000000 -0.000000\n-0.000000 3.911005 -0.000000\n-1.955502 -1.955502 6.344375\nSr Rh O\n2 1 4\ndirect\n0.645202 0.645202 0.290407 Sr\n0.354796 0.354796 0.709592 Sr\n0.000000 0.000000 0.000000 Rh\n0.837535 0.837535 0.675070 O\n0.162464 0.162464 0.324930 O\n0.000000 0.499999 0.000000 O\n0.499999 0.000000 0.000000 O\n",
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{
"id": "jvasp-78823",
"created_at": "2022-09-04T14:36:37.426599Z",
"updated_at": "2022-09-04T14:36:37.426620Z",
"structure_string": "Sr2 Rh1\n1.0\n-3.640488 -3.640488 0.000000\n-3.640488 -0.000000 -3.640488\n0.000000 -3.640488 -3.640488\nSr Rh\n2 1\ndirect\n0.250000 0.250000 0.250000 Sr\n0.750000 0.750000 0.750000 Sr\n0.000000 0.000000 0.000000 Rh\n",
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{
"id": "jvasp-50453",
"created_at": "2022-09-04T14:37:28.082135Z",
"updated_at": "2022-09-04T14:37:28.082162Z",
"structure_string": "Sr2 Pt6 O8\n1.0\n5.920563 -0.000000 0.000000\n0.000000 5.920563 0.000000\n-0.000000 -0.000000 5.920563\nSr Pt O\n2 6 8\ndirect\n0.000000 0.000000 0.000000 Sr\n0.500000 0.500000 0.500000 Sr\n0.750000 0.500000 0.000000 Pt\n0.250000 0.500000 0.000000 Pt\n0.500000 0.000000 0.750000 Pt\n0.000000 0.750000 0.500000 Pt\n0.000000 0.250000 0.500000 Pt\n0.500000 0.000000 0.250000 Pt\n0.750000 0.750000 0.750000 O\n0.750000 0.250000 0.750000 O\n0.250000 0.750000 0.750000 O\n0.250000 0.250000 0.750000 O\n0.750000 0.750000 0.250000 O\n0.250000 0.750000 0.250000 O\n0.750000 0.250000 0.250000 O\n0.250000 0.250000 0.250000 O\n",
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{
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"created_at": "2022-09-04T14:37:46.199277Z",
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"structure_string": "Sr2 Pt4\n1.0\n4.819469 0.000000 2.782522\n1.606489 4.543839 2.782522\n-0.000000 -0.000000 5.565043\nSr Pt\n2 4\ndirect\n0.875000 0.875000 0.874999 Sr\n0.125000 0.125000 0.125000 Sr\n0.500000 0.500000 0.499999 Pt\n0.500000 0.500000 -0.000000 Pt\n0.000000 0.500000 0.500000 Pt\n0.500000 0.000000 0.500000 Pt\n",
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},
{
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"created_at": "2022-09-04T14:36:37.081956Z",
"updated_at": "2022-09-04T14:36:37.081976Z",
"structure_string": "Sr2 Pt1 N2\n1.0\n3.698316 0.000424 -1.069364\n-0.308934 3.685391 -1.069364\n0.010777 0.011720 6.968333\nSr Pt N\n2 1 2\ndirect\n0.149250 0.649248 0.798498 Sr\n0.850753 0.350750 0.201503 Sr\n0.500001 -0.000001 0.500000 Pt\n0.650042 0.150040 0.800080 N\n0.349961 0.849959 0.199921 N\n",
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