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{
"id": "jvasp-118437",
"created_at": "2022-09-04T14:38:50.650306Z",
"updated_at": "2022-09-04T14:38:50.650336Z",
"structure_string": "Sr1 H1 I1\n1.0\n7.404471 0.000000 0.000000\n0.000000 7.404471 0.000000\n0.000000 -0.000000 9.456244\nSr H I\n1 1 1\ndirect\n0.000000 0.000000 0.582470 Sr\n0.000000 0.000000 0.351668 H\n0.000000 -0.000000 -0.097694 I\n",
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{
"id": "jvasp-118435",
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"structure_string": "Sr1 H1 I2\n1.0\n4.733208 0.000000 0.000000\n0.000000 4.733208 0.000000\n-0.000000 0.000000 6.304123\nSr H I\n1 1 2\ndirect\n0.500001 0.500001 0.502296 Sr\n0.000000 0.000000 0.002664 H\n0.000000 0.000000 0.502721 I\n0.500001 0.500001 0.002320 I\n",
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{
"id": "jvasp-118504",
"created_at": "2022-09-04T14:38:51.059760Z",
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"structure_string": "Sr1 H1 Se1\n1.0\n5.025273 -0.000000 -0.000000\n-2.512636 4.352014 0.000000\n-0.000000 0.000000 5.092352\nSr H Se\n1 1 1\ndirect\n0.666665 0.333333 0.000000 Sr\n0.000000 0.000000 0.000000 H\n0.333332 0.666666 0.000000 Se\n",
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"volume": 111.37003588706796,
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"formula_full": "Sr1 H1 Se1",
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{
"id": "jvasp-118506",
"created_at": "2022-09-04T14:38:50.832115Z",
"updated_at": "2022-09-04T14:38:50.832146Z",
"structure_string": "Sr1 H1 Se2\n1.0\n4.436797 -0.000000 -0.000000\n0.000000 4.436797 -0.000000\n0.000000 0.000000 6.075909\nSr H Se\n1 1 2\ndirect\n0.500000 0.500000 0.444644 Sr\n0.000000 0.000000 0.188895 H\n0.000000 0.000000 0.434742 Se\n0.500000 0.500000 0.941720 Se\n",
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"volume": 119.60528710406057,
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"formula_full": "Sr1 H1 Se2",
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"spacegroup": 99
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{
"id": "jvasp-118063",
"created_at": "2022-09-04T14:38:49.683414Z",
"updated_at": "2022-09-04T14:38:49.683438Z",
"structure_string": "Sr1 H2 Cl1\n1.0\n4.493619 -0.000000 0.000000\n0.000000 4.493619 0.000000\n-0.000000 -0.000000 5.549110\nSr H Cl\n1 2 1\ndirect\n0.500000 0.500000 0.000000 Sr\n0.000000 0.000000 0.068266 H\n0.000000 0.000000 -0.068265 H\n0.500000 0.500000 0.500000 Cl\n",
"nsites": 4,
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"elements": [
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"density": 1.8537534540332334,
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"formula_full": "Sr1 H2 Cl1",
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"spacegroup": 123
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{
"id": "jvasp-37312",
"created_at": "2022-09-04T14:38:17.875878Z",
"updated_at": "2022-09-04T14:38:17.875903Z",
"structure_string": "Sr1 H3\n1.0\n-2.012913 2.012913 2.846750\n2.012913 -2.012913 2.846750\n2.012913 2.012913 -2.846750\nSr H\n1 3\ndirect\n0.000000 0.000000 0.000000 Sr\n0.749999 0.250000 0.499999 H\n0.250000 0.749999 0.499999 H\n0.499999 0.499999 0.000000 H\n",
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{
"id": "jvasp-101060",
"created_at": "2022-09-04T14:36:54.976689Z",
"updated_at": "2022-09-04T14:36:54.976710Z",
"structure_string": "Sr1 H3 Pd1\n1.0\n3.837905 -0.000000 0.000000\n0.000000 3.837905 0.000000\n-0.000000 0.000000 3.837905\nSr H Pd\n1 3 1\ndirect\n0.499999 0.499999 0.499999 Sr\n0.499999 0.000000 -0.000000 H\n-0.000000 0.499999 -0.000000 H\n0.000000 0.000000 0.499999 H\n0.000000 0.000000 0.000000 Pd\n",
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"formula_full": "Sr1 H3 Pd1",
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"spacegroup": 221
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{
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"created_at": "2022-09-04T14:35:49.278875Z",
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"structure_string": "Sr1 Hf1 Mg6\n1.0\n6.359079 -1.702624 0.000000\n-4.654055 8.061061 0.000000\n0.000000 0.000000 4.664325\nSr Hf Mg\n1 1 6\ndirect\n0.249983 0.374991 0.250000 Sr\n0.250020 0.875008 0.250000 Hf\n0.750030 0.375035 0.250000 Mg\n0.750030 0.874994 0.250000 Mg\n0.249997 0.103966 0.750001 Mg\n0.249998 0.646033 0.750001 Mg\n0.707950 0.103975 0.750001 Mg\n0.791998 0.646000 0.750001 Mg\n",
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"density": 3.384053642472416,
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"formula_full": "Sr1 Hf1 Mg6",
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{
"id": "jvasp-92203",
"created_at": "2022-09-04T14:35:58.089419Z",
"updated_at": "2022-09-04T14:35:58.089437Z",
"structure_string": "Sr1 Hf1 Mg6\n1.0\n6.636760 0.000119 0.000000\n-3.318276 5.747662 0.000000\n0.000000 0.000000 5.172311\nSr Hf Mg\n1 1 6\ndirect\n0.083327 0.416673 0.250000 Sr\n0.416656 0.083344 0.750000 Hf\n0.097337 0.923697 0.250000 Mg\n0.576302 0.402662 0.250000 Mg\n0.576343 0.923656 0.250000 Mg\n0.435241 0.592599 0.750000 Mg\n0.907401 0.064759 0.750000 Mg\n0.907391 0.592609 0.750000 Mg\n",
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{
"id": "jvasp-1681",
"created_at": "2022-09-04T14:37:00.299866Z",
"updated_at": "2022-09-04T14:37:00.299898Z",
"structure_string": "Sr1 Hf1 N2\n1.0\n3.227090 0.001652 5.314381\n1.488440 2.863330 5.314381\n0.002720 0.001652 6.217455\nSr Hf N\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Sr\n0.500000 0.499999 0.500000 Hf\n0.767217 0.767215 0.767216 N\n0.232784 0.232783 0.232783 N\n",
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},
{
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"created_at": "2022-09-04T14:36:37.857774Z",
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"structure_string": "Sr1 Hf1 O3\n1.0\n4.125872 0.000000 0.000000\n-0.000000 4.125872 0.000000\n-0.000000 -0.000000 4.125872\nSr Hf O\n1 1 3\ndirect\n0.500000 0.500000 0.500000 Sr\n0.000000 0.000000 0.000000 Hf\n0.000000 0.500000 0.000000 O\n0.000000 0.000000 0.500000 O\n0.500000 0.000000 0.000000 O\n",
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{
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"created_at": "2022-09-04T14:36:34.432346Z",
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"structure_string": "Sr1 Hf1 O3\n1.0\n4.125890 0.000000 0.000000\n0.000000 4.125890 0.000000\n0.000000 -0.000000 4.125822\nSr Hf O\n1 1 3\ndirect\n0.500000 0.500000 0.489914 Sr\n0.000000 0.000000 0.988999 Hf\n0.500000 0.000000 0.988189 O\n0.000000 0.500000 0.988189 O\n0.000000 0.000000 0.488709 O\n",
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