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{
"id": "jvasp-121224",
"created_at": "2022-09-04T14:38:55.203781Z",
"updated_at": "2022-09-04T14:38:55.203816Z",
"structure_string": "Rb1 Mg1 O1\n1.0\n3.158549 0.950608 0.000000\n-0.466192 7.094712 0.000000\n0.000000 0.000000 3.978169\nRb Mg O\n1 1 1\ndirect\n0.449254 0.380017 0.000000 Rb\n-0.330110 -0.073156 0.000000 Mg\n0.101871 0.067176 0.000000 O\n",
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{
"id": "jvasp-115309",
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"updated_at": "2022-09-04T14:38:42.047717Z",
"structure_string": "Sr1 S1 O1\n1.0\n4.717598 0.000000 -0.000000\n-2.358799 4.085560 -0.000000\n0.000000 0.000000 4.716926\nSr S O\n1 1 1\ndirect\n0.666667 0.333334 0.000000 Sr\n0.333334 0.666667 0.000000 S\n0.000000 0.000000 0.000000 O\n",
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{
"id": "jvasp-109478",
"created_at": "2022-09-04T14:38:27.492017Z",
"updated_at": "2022-09-04T14:38:27.492044Z",
"structure_string": "Rb2 Tb1 Au1 Cl6\n1.0\n6.529613 -0.000000 3.769874\n2.176538 6.156178 3.769874\n-0.000000 -0.000000 7.539747\nTb Rb Au Cl\n1 2 1 6\ndirect\n0.000000 0.000000 0.000000 Tb\n0.750000 0.750000 0.749999 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Au\n0.753687 0.246312 0.246312 Cl\n0.246312 0.246312 0.753688 Cl\n0.246312 0.753688 0.753687 Cl\n0.246312 0.753688 0.246312 Cl\n0.753687 0.246312 0.753688 Cl\n0.753688 0.753688 0.246312 Cl\n",
"nsites": 10,
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"formula_full": "Rb2 Tb1 Au1 Cl6",
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"spacegroup": 225
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{
"id": "jvasp-110811",
"created_at": "2022-09-04T14:38:36.521685Z",
"updated_at": "2022-09-04T14:38:36.521709Z",
"structure_string": "La2 Mg1 Cd1\n1.0\n4.811169 0.000000 2.777730\n1.603723 4.536013 2.777730\n-0.000000 -0.000000 5.555459\nLa Mg Cd\n2 1 1\ndirect\n0.250000 0.250000 0.250000 La\n0.750000 0.749999 0.750001 La\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500000 0.500000 Cd\n",
"nsites": 4,
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"elements": [
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],
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"density": 5.677498238535473,
"density_atomic": 0.03299249363038093,
"volume": 121.23969909072362,
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"formula_full": "La2 Mg1 Cd1",
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"spacegroup": 225
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{
"id": "jvasp-56335",
"created_at": "2022-09-04T14:37:31.571137Z",
"updated_at": "2022-09-04T14:37:31.571148Z",
"structure_string": "Ce2 Br6\n1.0\n3.975320 -6.885455 -0.000000\n3.975320 6.885455 0.000000\n0.000000 -0.000000 4.429444\nCe Br\n2 6\ndirect\n0.666667 0.333333 0.250000 Ce\n0.333333 0.666667 0.749999 Ce\n0.913854 0.297838 0.749999 Br\n0.086147 0.702162 0.250000 Br\n0.616015 0.913853 0.250000 Br\n0.383985 0.086147 0.749999 Br\n0.297838 0.383985 0.250000 Br\n0.702162 0.616015 0.749999 Br\n",
"nsites": 8,
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"elements": [
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},
{
"id": "jvasp-2997",
"created_at": "2022-09-04T14:36:57.038322Z",
"updated_at": "2022-09-04T14:36:57.038354Z",
"structure_string": "Sr1 Mg2 Sb2\n1.0\n2.363196 -4.093175 0.000000\n2.363196 4.093175 0.000000\n0.000000 0.000000 7.834092\nSr Mg Sb\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Sr\n0.666668 0.333334 0.371677 Mg\n0.333334 0.666668 0.628322 Mg\n0.333334 0.666668 0.255519 Sb\n0.666668 0.333334 0.744481 Sb\n",
"nsites": 5,
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{
"id": "jvasp-25046",
"created_at": "2022-09-04T14:37:42.619654Z",
"updated_at": "2022-09-04T14:37:42.619666Z",
"structure_string": "Tl1\n1.0\n3.047165 -0.000000 -1.607676\n-0.848205 2.926733 -1.607676\n-0.087118 -0.115951 3.526491\nTl\n1\ndirect\n0.000000 0.000000 0.000000 Tl\n",
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{
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"created_at": "2022-09-04T14:37:16.801017Z",
"updated_at": "2022-09-04T14:37:16.801032Z",
"structure_string": "Tl1\n1.0\n3.047166 -0.000000 -1.607677\n-0.848206 2.926734 -1.607677\n-0.087118 -0.115951 3.526492\nTl\n1\ndirect\n0.000000 0.000000 0.000000 Tl\n",
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{
"id": "jvasp-7806",
"created_at": "2022-09-04T14:36:32.211290Z",
"updated_at": "2022-09-04T14:36:32.211310Z",
"structure_string": "Tl1\n1.0\n3.047166 -0.000000 -1.607677\n-0.848206 2.926734 -1.607677\n-0.087118 -0.115951 3.526492\nTl\n1\ndirect\n0.000000 0.000000 0.000000 Tl\n",
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{
"id": "jvasp-111112",
"created_at": "2022-09-04T14:38:37.020212Z",
"updated_at": "2022-09-04T14:38:37.020240Z",
"structure_string": "Ag1 Bi1 Te2\n1.0\n4.421144 0.000000 0.000000\n0.000000 4.421144 0.000000\n0.000000 0.000000 6.203489\nAg Bi Te\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Ag\n0.500000 0.500000 0.500000 Bi\n0.000000 0.000000 0.500000 Te\n0.500000 0.500000 -0.000000 Te\n",
"nsites": 4,
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},
{
"id": "jvasp-49210",
"created_at": "2022-09-04T14:38:30.177100Z",
"updated_at": "2022-09-04T14:38:30.177116Z",
"structure_string": "Na12 Mn2 Te8\n1.0\n5.009161 -8.676121 -0.000000\n5.009161 8.676121 0.000000\n0.000000 0.000000 7.672733\nNa Mn Te\n12 2 8\ndirect\n0.298519 0.149260 0.456600 Na\n0.946908 0.473454 0.129114 Na\n0.473454 0.946908 0.629114 Na\n0.526546 0.053092 0.129114 Na\n0.526546 0.473454 0.129114 Na\n0.053092 0.526546 0.629114 Na\n0.473454 0.526546 0.629114 Na\n0.850740 0.149260 0.456600 Na\n0.850740 0.701481 0.456600 Na\n0.149260 0.298519 0.956599 Na\n0.149260 0.850740 0.956599 Na\n0.701481 0.850740 0.956599 Na\n0.666667 0.333333 0.748130 Mn\n0.333333 0.666667 0.248130 Mn\n0.815276 0.184724 0.858523 Te\n0.666667 0.333333 0.392457 Te\n0.333333 0.666667 0.892457 Te\n0.369449 0.184724 0.858523 Te\n0.184724 0.815276 0.358523 Te\n0.184724 0.369449 0.358523 Te\n0.815276 0.630551 0.858523 Te\n0.630551 0.815276 0.358523 Te\n",
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{
"id": "jvasp-29045",
"created_at": "2022-09-04T14:37:06.624482Z",
"updated_at": "2022-09-04T14:37:06.624514Z",
"structure_string": "Te2 Mo1 W3 Se2 S4\n1.0\n3.310733 0.000000 0.000000\n-1.655367 2.867179 -0.000137\n0.000000 -0.001809 38.324232\nTe Mo W Se S\n2 1 3 2 4\ndirect\n0.666601 0.333203 0.042909 Te\n0.666671 0.333342 0.142689 Te\n0.333302 0.666605 0.092711 Mo\n0.333280 0.666562 0.469796 W\n0.666722 0.333447 0.282748 W\n0.666690 0.333384 0.657626 W\n0.333425 0.666853 0.326822 Se\n0.333353 0.666710 0.238698 Se\n0.333382 0.666766 0.697607 S\n0.666586 0.333172 0.429708 S\n0.666644 0.333289 0.509875 S\n0.333333 0.666668 0.617557 S\n",
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