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{
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"results": [
{
"id": "jvasp-18005",
"created_at": "2022-09-04T14:38:14.561168Z",
"updated_at": "2022-09-04T14:38:14.561185Z",
"structure_string": "In2 Sb2\n1.0\n4.345758 0.160074 0.000000\n-0.159797 4.345768 0.000000\n-0.000000 -0.000000 6.152155\nIn Sb\n2 2\ndirect\n0.749999 0.749999 0.250000 In\n0.250001 0.250001 0.750001 In\n0.250000 0.250000 0.250000 Sb\n0.750000 0.749999 0.750001 Sb\n",
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{
"id": "jvasp-14093",
"created_at": "2022-09-04T14:36:42.210353Z",
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"structure_string": "In2 Sb2\n1.0\n4.345758 0.160074 0.000000\n-0.159797 4.345768 0.000000\n-0.000000 -0.000000 6.152155\nIn Sb\n2 2\ndirect\n0.749999 0.749999 0.250000 In\n0.250001 0.250001 0.750001 In\n0.250000 0.250000 0.250000 Sb\n0.750000 0.749999 0.750001 Sb\n",
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{
"id": "jvasp-76258",
"created_at": "2022-09-04T14:36:42.620617Z",
"updated_at": "2022-09-04T14:36:42.620641Z",
"structure_string": "Na4 Cl2\n1.0\n0.000000 0.000000 -3.933419\n-6.662142 -0.000000 0.000000\n3.331072 6.659767 0.000000\nNa Cl\n4 2\ndirect\n0.000000 0.500000 0.000000 Na\n0.500000 0.000000 0.000000 Na\n0.500000 0.294785 0.589570 Na\n0.500000 0.705215 0.410431 Na\n0.000000 0.847818 0.695637 Cl\n0.000000 0.152182 0.304364 Cl\n",
"nsites": 6,
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"elements": [
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"volume": 174.51916708644654,
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"formula_full": "Na4 Cl2",
"formula_reduced": "Na2Cl",
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"spacegroup": 65
},
{
"id": "jvasp-15903",
"created_at": "2022-09-04T14:37:53.954659Z",
"updated_at": "2022-09-04T14:37:53.954690Z",
"structure_string": "In1 Sb1\n1.0\n3.766621 -0.000000 2.174660\n1.255540 3.551205 2.174660\n0.000000 0.000000 4.349319\nIn Sb\n1 1\ndirect\n0.000000 0.000000 0.000000 In\n0.500000 0.499999 0.500000 Sb\n",
"nsites": 2,
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"elements": [
"In",
"Sb"
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"chemical_system": "In-Sb",
"density": 6.752654420972816,
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"volume": 58.17667939262018,
"volume_molar": 17.5174076125875,
"formula_full": "In1 Sb1",
"formula_reduced": "InSb",
"formula_anonymous": "AB",
"energy_above_hull": 0.376133035,
"spacegroup": 225
},
{
"id": "jvasp-100876",
"created_at": "2022-09-04T14:36:37.634911Z",
"updated_at": "2022-09-04T14:36:37.634931Z",
"structure_string": "Na2 Hg1 As1 Cl6\n1.0\n6.440868 -0.000000 3.718637\n2.146956 6.072509 3.718637\n-0.000000 -0.000000 7.437274\nNa Hg As Cl\n2 1 1 6\ndirect\n0.750001 0.750000 0.750000 Na\n0.250000 0.250000 0.250000 Na\n0.500000 0.500000 0.500000 Hg\n0.000000 0.000000 0.000000 As\n0.762196 0.237805 0.237805 Cl\n0.237805 0.237805 0.762195 Cl\n0.237805 0.762196 0.762195 Cl\n0.237805 0.762196 0.237805 Cl\n0.762196 0.237805 0.762195 Cl\n0.762196 0.762196 0.237805 Cl\n",
"nsites": 10,
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"elements": [
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"Hg",
"As",
"Cl"
],
"chemical_system": "As-Cl-Hg-Na",
"density": 3.0495380941698826,
"density_atomic": 0.034377449460941754,
"volume": 290.8883630637459,
"volume_molar": 17.517706678158625,
"formula_full": "Na2 Hg1 As1 Cl6",
"formula_reduced": "Na2HgAsCl6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-105354",
"created_at": "2022-09-04T14:36:49.071103Z",
"updated_at": "2022-09-04T14:36:49.071137Z",
"structure_string": "Tl1 In1\n1.0\n3.329157 0.023148 5.002595\n1.529593 2.957054 5.002595\n0.037739 0.023148 6.008979\nTl In\n1 1\ndirect\n0.500000 0.500000 0.500001 Tl\n0.000000 0.000000 0.000000 In\n",
"nsites": 2,
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"elements": [
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],
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"density": 9.110403289420185,
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"volume": 58.18032549393764,
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"formula_anonymous": "AB",
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"spacegroup": 166
},
{
"id": "jvasp-35647",
"created_at": "2022-09-04T14:37:30.033448Z",
"updated_at": "2022-09-04T14:37:30.033472Z",
"structure_string": "Y1 Sb2\n1.0\n3.557998 0.000000 0.000000\n-1.778999 3.218327 0.000000\n0.000000 0.000000 7.621432\nY Sb\n1 2\ndirect\n0.000000 0.000000 0.000000 Y\n0.000000 0.500001 0.681602 Sb\n0.500000 0.500001 0.318398 Sb\n",
"nsites": 3,
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"elements": [
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"Sb"
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"density": 6.3251588648799775,
"density_atomic": 0.03437548285745451,
"volume": 87.27150139069055,
"volume_molar": 17.518708857042476,
"formula_full": "Y1 Sb2",
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"formula_anonymous": "AB2",
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"spacegroup": 21
},
{
"id": "jvasp-79875",
"created_at": "2022-09-04T14:36:51.761844Z",
"updated_at": "2022-09-04T14:36:51.761874Z",
"structure_string": "Na1 Pm1 Te2\n1.0\n-0.000000 3.874909 3.874909\n3.874909 -0.000000 3.874909\n3.874909 3.874909 -0.000000\nNa Pm Te\n1 1 2\ndirect\n0.250000 0.250000 0.250000 Na\n0.750001 0.750001 0.750001 Pm\n0.500001 0.500001 0.500001 Te\n0.000000 0.000000 0.000000 Te\n",
"nsites": 4,
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"elements": [
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"Pm",
"Te"
],
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"density": 6.039065476938529,
"density_atomic": 0.03437521888624462,
"volume": 116.36289541128176,
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"formula_full": "Na1 Pm1 Te2",
"formula_reduced": "NaPmTe2",
"formula_anonymous": "ABC2",
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"spacegroup": 225
},
{
"id": "jvasp-58946",
"created_at": "2022-09-04T14:38:34.475738Z",
"updated_at": "2022-09-04T14:38:34.475748Z",
"structure_string": "Na6 Y2 Br12\n1.0\n0.000000 7.092632 -0.016140\n7.681112 0.000000 0.000000\n0.000000 -6.959507 -10.664495\nNa Y Br\n6 2 12\ndirect\n0.500000 0.500000 0.000000 Na\n0.706042 0.595487 0.744009 Na\n0.293957 0.095487 0.755991 Na\n0.499999 0.000000 0.500000 Na\n0.706042 0.904513 0.244009 Na\n0.293957 0.404513 0.255991 Na\n-0.000000 0.500000 0.500000 Y\n0.000000 0.000000 0.000000 Y\n0.092276 0.442235 0.741864 Br\n0.907722 0.942235 0.758136 Br\n0.907723 0.557765 0.258136 Br\n0.092277 0.057765 0.241864 Br\n0.757855 0.188400 0.422974 Br\n0.393155 0.178314 0.071236 Br\n0.242144 0.811600 0.577026 Br\n0.757854 0.311600 0.922973 Br\n0.606844 0.821686 0.928764 Br\n0.606845 0.678314 0.428764 Br\n0.242145 0.688400 0.077026 Br\n0.393154 0.321686 0.571236 Br\n",
"nsites": 20,
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"elements": [
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"Y",
"Br"
],
"chemical_system": "Br-Na-Y",
"density": 3.63752642853573,
"density_atomic": 0.0343727053597206,
"volume": 581.8570226199552,
"volume_molar": 17.52012446205937,
"formula_full": "Na6 Y2 Br12",
"formula_reduced": "Na3YBr6",
"formula_anonymous": "AB3C6",
"energy_above_hull": 0.0,
"spacegroup": 14
},
{
"id": "jvasp-105717",
"created_at": "2022-09-04T14:35:58.857029Z",
"updated_at": "2022-09-04T14:35:58.857054Z",
"structure_string": "Al1 Pb3\n1.0\n4.396755 -0.186790 -3.914085\n-1.007606 4.283815 -3.914085\n0.154517 0.186790 5.884525\nAl Pb\n1 3\ndirect\n0.000000 0.000000 0.000000 Al\n0.749999 0.250000 0.500000 Pb\n0.249999 0.750001 0.500001 Pb\n0.499999 0.500001 0.000001 Pb\n",
"nsites": 4,
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"elements": [
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],
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"density": 9.25398090224402,
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"volume": 116.3818030421559,
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"formula_full": "Al1 Pb3",
"formula_reduced": "AlPb3",
"formula_anonymous": "AB3",
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"spacegroup": 139
},
{
"id": "jvasp-102737",
"created_at": "2022-09-04T14:36:56.848778Z",
"updated_at": "2022-09-04T14:36:56.848788Z",
"structure_string": "K4 Na1 Cl5\n1.0\n4.321598 0.003314 -14.994520\n-0.083017 4.320802 -14.994520\n-0.003248 -0.003314 15.604865\nK Na Cl\n4 1 5\ndirect\n0.402064 0.402064 -0.000001 K\n0.802147 0.802146 -0.000001 K\n0.197853 0.197853 -0.000000 K\n0.597936 0.597935 -0.000001 K\n0.000000 0.000000 0.000000 Na\n0.094027 0.094027 -0.000000 Cl\n0.500000 0.499999 -0.000001 Cl\n0.905973 0.905972 -0.000001 Cl\n0.300285 0.300285 -0.000000 Cl\n0.699715 0.699714 -0.000001 Cl\n",
"nsites": 10,
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"elements": [
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],
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"volume": 290.9611924110873,
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"formula_full": "K4 Na1 Cl5",
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"formula_anonymous": "AB4C5",
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"spacegroup": 139
},
{
"id": "jvasp-99325",
"created_at": "2022-09-04T14:36:41.968299Z",
"updated_at": "2022-09-04T14:36:41.968316Z",
"structure_string": "Rb8 Co4 Cl16\n1.0\n7.070423 0.000000 0.000000\n-0.000000 9.298940 0.000000\n0.000000 0.000000 12.391559\nRb Co Cl\n8 4 16\ndirect\n0.750000 0.978802 0.829588 Rb\n0.750000 0.478802 0.670412 Rb\n0.250000 0.521198 0.329588 Rb\n0.750000 0.631809 0.095093 Rb\n0.250000 0.368191 0.904907 Rb\n0.750000 0.131809 0.404907 Rb\n0.250000 0.868191 0.595093 Rb\n0.250000 0.021198 0.170412 Rb\n0.750000 0.228958 0.075794 Co\n0.250000 0.771042 0.924206 Co\n0.750000 0.728958 0.424206 Co\n0.250000 0.271042 0.575794 Co\n0.250000 0.511569 0.597734 Cl\n0.750000 0.488431 0.402266 Cl\n0.493776 0.826172 0.347162 Cl\n0.750000 0.314505 0.905752 Cl\n0.250000 0.685495 0.094248 Cl\n0.750000 0.814505 0.594248 Cl\n0.250000 0.185495 0.405752 Cl\n0.493776 0.326172 0.152838 Cl\n-0.006224 0.673828 0.847162 Cl\n0.006224 0.826172 0.347162 Cl\n0.506224 0.173828 0.652838 Cl\n0.506224 0.673828 0.847162 Cl\n0.006224 0.326172 0.152838 Cl\n-0.006224 0.173828 0.652838 Cl\n0.750000 0.988430 0.097734 Cl\n0.250000 0.011569 0.902266 Cl\n",
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"formula_full": "Rb8 Co4 Cl16",
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}