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{
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"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-chemical_system&page=377",
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"results": [
{
"id": "jvasp-30314",
"created_at": "2022-09-04T14:38:03.817290Z",
"updated_at": "2022-09-04T14:38:03.817309Z",
"structure_string": "Si6 Sb4 O18\n1.0\n6.920375 0.000001 -0.000008\n-3.460186 5.993225 -0.000008\n-0.000008 -0.000019 9.323547\nSi Sb O\n6 4 18\ndirect\n0.206877 0.926026 0.249999 Si\n0.073977 0.280847 0.250000 Si\n0.280849 0.206873 0.750000 Si\n0.719157 0.793126 0.250000 Si\n0.926029 0.719152 0.750000 Si\n0.793130 0.073973 0.750001 Si\n0.666671 0.333334 0.018465 Sb\n0.666669 0.333332 0.481536 Sb\n0.333336 0.666665 0.981536 Sb\n0.333337 0.666668 0.518465 Sb\n0.421571 0.325764 0.604827 O\n0.674238 0.095802 0.604828 O\n0.904200 0.578431 0.895172 O\n0.904201 0.578432 0.604826 O\n0.935572 0.752523 0.249999 O\n0.752526 0.816954 0.750000 O\n0.421569 0.325765 0.895174 O\n0.578437 0.674236 0.395174 O\n0.095806 0.421568 0.104827 O\n0.247481 0.183045 0.250000 O\n0.064435 0.247476 0.750001 O\n0.095806 0.421568 0.395174 O\n0.674239 0.095803 0.895174 O\n0.325768 0.904197 0.395172 O\n0.325768 0.904196 0.104826 O\n0.183047 0.935566 0.750000 O\n0.578436 0.674234 0.104827 O\n0.816960 0.064433 0.250000 O\n",
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],
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"volume": 386.6975421383578,
"volume_molar": 8.316953679654365,
"formula_full": "Si6 Sb4 O18",
"formula_reduced": "Si3Sb2O9",
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"spacegroup": 176
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{
"id": "jvasp-113716",
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"structure_string": "Si1 Sb1 O1\n1.0\n3.031305 0.000000 -0.000000\n-0.000000 3.031305 0.000000\n-0.000000 -0.000000 6.711804\nSi Sb O\n1 1 1\ndirect\n0.000000 0.000000 0.044001 Si\n0.000000 0.000000 0.589624 Sb\n0.000000 0.000000 0.285013 O\n",
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],
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"density_atomic": 0.04864326496967819,
"volume": 61.67349173354321,
"volume_molar": 12.38021494600312,
"formula_full": "Si1 Sb1 O1",
"formula_reduced": "SiSbO",
"formula_anonymous": "ABC",
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"spacegroup": 99
},
{
"id": "jvasp-111757",
"created_at": "2022-09-04T14:38:41.221916Z",
"updated_at": "2022-09-04T14:38:41.221942Z",
"structure_string": "Yb4 Sc4 Sb4 O1\n1.0\n4.448349 0.000000 0.000000\n0.000000 4.448349 -0.000000\n0.000000 0.000000 16.033059\nYb Sc Sb O\n4 4 4 1\ndirect\n0.500000 0.500000 0.330625 Yb\n0.000000 0.000000 0.835067 Yb\n0.000000 0.000000 0.164933 Yb\n0.500000 0.500000 0.669375 Yb\n0.500000 0.000000 0.000000 Sc\n0.000000 0.500000 0.500000 Sc\n0.000000 0.500000 0.000000 Sc\n0.500000 0.000000 0.500000 Sc\n0.500000 0.500000 0.131760 Sb\n0.000000 0.000000 0.632468 Sb\n0.000000 0.000000 0.367532 Sb\n0.500000 0.500000 0.868240 Sb\n0.000000 0.000000 0.000000 O\n",
"nsites": 13,
"nelements": 4,
"elements": [
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"Sc",
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"O"
],
"chemical_system": "O-Sb-Sc-Yb",
"density": 7.196891886564563,
"density_atomic": 0.04097597118058111,
"volume": 317.25910638478825,
"volume_molar": 14.696761508007766,
"formula_full": "Yb4 Sc4 Sb4 O1",
"formula_reduced": "Yb4Sc4Sb4O",
"formula_anonymous": "AB4C4D4",
"energy_above_hull": 1.4246001307692309,
"spacegroup": 123
},
{
"id": "jvasp-59746",
"created_at": "2022-09-04T14:38:31.031123Z",
"updated_at": "2022-09-04T14:38:31.031149Z",
"structure_string": "Sb8 O16\n1.0\n6.447878 -0.000000 3.722684\n2.149292 6.079117 3.722684\n-0.000000 -0.000000 7.445369\nSb O\n8 16\ndirect\n0.751194 0.751194 0.751193 Sb\n0.753582 0.248806 0.248805 Sb\n0.248806 0.753582 0.248805 Sb\n0.246418 0.751194 0.751194 Sb\n0.751194 0.246418 0.751193 Sb\n0.751194 0.751194 0.246417 Sb\n0.248806 0.248806 0.248806 Sb\n0.248806 0.248806 0.753582 Sb\n0.179632 0.179632 0.570368 O\n0.179631 0.570369 0.179631 O\n0.429631 0.820369 0.429631 O\n0.820368 0.429632 0.820368 O\n-0.000000 0.500000 -0.000000 O\n0.820368 0.820369 0.429631 O\n0.570368 0.179632 0.179631 O\n0.570368 0.570369 0.179631 O\n0.570368 0.179632 0.570368 O\n0.429631 0.820369 0.820368 O\n0.179631 0.570369 0.570368 O\n0.000000 0.000000 0.000000 O\n0.000000 0.000000 0.500000 O\n0.500000 0.000000 -0.000000 O\n0.429632 0.429632 0.820368 O\n0.820368 0.429632 0.429631 O\n",
"nsites": 24,
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],
"chemical_system": "O-Sb",
"density": 6.998992450815642,
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"volume": 291.8391423082979,
"volume_molar": 7.322901642742672,
"formula_full": "Sb8 O16",
"formula_reduced": "SbO2",
"formula_anonymous": "AB2",
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"spacegroup": 227
},
{
"id": "jvasp-119150",
"created_at": "2022-09-04T14:38:51.403035Z",
"updated_at": "2022-09-04T14:38:51.403064Z",
"structure_string": "Sb6 O13\n1.0\n6.358777 0.000012 -3.729504\n-2.076970 5.993909 -3.755330\n0.008126 -0.000012 7.371783\nSb O\n6 13\ndirect\n0.247439 0.999636 0.247802 Sb\n0.751835 0.999636 0.752199 Sb\n0.746701 0.996211 0.249511 Sb\n0.746701 0.497190 0.750490 Sb\n0.252455 0.515605 0.263151 Sb\n0.252455 0.989304 0.736850 Sb\n0.654375 0.059333 0.981158 O\n0.654374 0.673216 0.595040 O\n0.078176 0.059333 0.404961 O\n0.676738 0.676738 0.000000 O\n0.069322 0.069322 0.000000 O\n0.839062 0.324890 0.908941 O\n0.839061 0.930121 0.514171 O\n0.078176 0.673216 0.018843 O\n0.415950 0.930121 0.091060 O\n0.816048 0.316047 0.500001 O\n0.426653 0.926652 0.500000 O\n0.415950 0.324890 0.485830 O\n0.163541 0.663540 0.500000 O\n",
"nsites": 19,
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"elements": [
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"density": 5.543331626877027,
"density_atomic": 0.06757980468332422,
"volume": 281.1490812829824,
"volume_molar": 8.91115443174106,
"formula_full": "Sb6 O13",
"formula_reduced": "Sb6O13",
"formula_anonymous": "A6B13",
"energy_above_hull": 2.6474522157894738,
"spacegroup": 44
},
{
"id": "jvasp-9458",
"created_at": "2022-09-04T14:38:04.755877Z",
"updated_at": "2022-09-04T14:38:04.755899Z",
"structure_string": "Sb4 O8\n1.0\n6.236335 -0.021858 -0.029306\n-3.096414 5.996071 -0.007080\n-3.096672 -1.755742 5.733210\nSb O\n4 8\ndirect\n0.500000 0.500000 -0.000000 Sb\n0.000000 0.500000 0.000000 Sb\n0.000000 0.500000 0.500000 Sb\n0.500000 -0.000000 -0.000000 Sb\n0.557799 0.301822 0.813663 O\n0.057795 0.313662 0.801820 O\n0.015750 0.705793 0.794273 O\n0.942206 0.686338 0.198179 O\n0.484252 0.705726 0.794208 O\n0.515749 0.294273 0.205791 O\n0.984251 0.294207 0.205727 O\n0.442202 0.698177 0.186336 O\n",
"nsites": 12,
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"elements": [
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"density": 4.789946370133531,
"density_atomic": 0.056281132430333065,
"volume": 213.21532602163003,
"volume_molar": 10.700105879096222,
"formula_full": "Sb4 O8",
"formula_reduced": "SbO2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.517941033333334,
"spacegroup": 74
},
{
"id": "jvasp-10034",
"created_at": "2022-09-04T14:37:10.529304Z",
"updated_at": "2022-09-04T14:37:10.529330Z",
"structure_string": "Sb4 O8\n1.0\n5.983604 -0.741250 0.599312\n2.349861 5.552577 0.599312\n3.267158 1.886295 5.335245\nSb O\n4 8\ndirect\n0.096564 0.096563 0.903437 Sb\n0.153436 0.153436 0.346564 Sb\n0.625000 0.625000 0.125000 Sb\n0.625000 0.625000 0.625000 Sb\n0.347803 0.347803 0.389127 O\n0.442385 0.800030 0.378792 O\n0.347803 0.347802 0.915268 O\n0.800030 0.442385 0.378792 O\n0.449970 0.807614 0.871208 O\n0.807615 0.449969 0.871208 O\n0.902196 0.902197 0.334733 O\n0.902196 0.902196 0.860874 O\n",
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"elements": [
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"density": 6.003277581438376,
"density_atomic": 0.07053758736918048,
"volume": 170.12206466878794,
"volume_molar": 8.53749183181053,
"formula_full": "Sb4 O8",
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"spacegroup": 74
},
{
"id": "jvasp-30585",
"created_at": "2022-09-04T14:37:18.775405Z",
"updated_at": "2022-09-04T14:37:18.775430Z",
"structure_string": "Sb1 O2\n1.0\n2.712505 -0.532391 2.534013\n0.760126 2.657692 2.534013\n-0.869900 -0.532391 3.608625\nSb O\n1 2\ndirect\n0.500002 0.499999 0.500000 Sb\n0.749872 0.749870 0.749871 O\n0.250130 0.250127 0.250128 O\n",
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"spacegroup": 225
},
{
"id": "jvasp-49175",
"created_at": "2022-09-04T14:37:17.944293Z",
"updated_at": "2022-09-04T14:37:17.944316Z",
"structure_string": "Sb8 O16\n1.0\n6.478490 0.000000 3.740358\n2.159496 6.107979 3.740358\n0.000000 0.000000 7.480717\nSb O\n8 16\ndirect\n0.500000 0.500000 0.500000 Sb\n0.000000 0.500000 0.500000 Sb\n0.500000 -0.000000 0.500000 Sb\n0.000000 0.000000 0.000000 Sb\n-0.000000 -0.000000 0.500000 Sb\n0.500000 -0.000000 0.000000 Sb\n0.000000 0.500000 -0.000000 Sb\n0.500000 0.500000 0.000000 Sb\n0.104306 0.104306 0.645694 O\n0.104307 0.645694 0.104306 O\n0.354307 0.895694 0.354307 O\n0.895694 0.354306 0.895694 O\n0.625000 0.625000 0.625000 O\n0.895694 0.895694 0.354307 O\n0.645694 0.104306 0.104307 O\n0.645694 0.645694 0.104307 O\n0.645694 0.104306 0.645694 O\n0.354307 0.895694 0.895694 O\n0.104307 0.645694 0.645694 O\n0.875000 0.875000 0.875001 O\n0.125000 0.125000 0.125000 O\n0.375000 0.375000 0.375000 O\n0.354307 0.354306 0.895694 O\n0.895694 0.354306 0.354307 O\n",
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"formula_full": "Sb8 O16",
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"spacegroup": 227
},
{
"id": "jvasp-29490",
"created_at": "2022-09-04T14:38:18.807941Z",
"updated_at": "2022-09-04T14:38:18.807963Z",
"structure_string": "Sb8 O12\n1.0\n3.356036 -0.000000 0.000000\n0.000000 7.739900 0.000000\n0.000000 0.000000 13.271029\nSb O\n8 12\ndirect\n0.749948 0.331186 0.615833 Sb\n0.250053 0.668814 0.384167 Sb\n0.250053 0.168814 0.115833 Sb\n0.750054 0.331186 0.884167 Sb\n0.750054 0.831186 0.615833 Sb\n0.749948 0.831186 0.884167 Sb\n0.249948 0.168814 0.384167 Sb\n0.249948 0.668814 0.115833 Sb\n0.750001 0.209094 0.750000 O\n0.749963 0.310141 0.426830 O\n0.750039 0.810141 0.426830 O\n0.750001 0.709094 0.750000 O\n0.250000 0.790906 0.250000 O\n0.749963 0.810141 0.073170 O\n0.250000 0.290906 0.250000 O\n0.750039 0.310141 0.073170 O\n0.250038 0.689859 0.573170 O\n0.250038 0.189859 0.926831 O\n0.249963 0.689859 0.926831 O\n0.249963 0.189859 0.573170 O\n",
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"formula_full": "Sb8 O12",
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"spacegroup": 59
},
{
"id": "jvasp-9912",
"created_at": "2022-09-04T14:38:29.940088Z",
"updated_at": "2022-09-04T14:38:29.940107Z",
"structure_string": "Sb4 O8\n1.0\n3.300585 0.000000 0.000000\n-1.650294 5.294688 0.000000\n-0.000000 0.000000 11.133255\nSb O\n4 8\ndirect\n0.866604 0.733205 0.077861 Sb\n0.133399 0.266795 0.922139 Sb\n0.866604 0.733205 0.422139 Sb\n0.133399 0.266795 0.577860 Sb\n0.243585 0.487168 0.407555 O\n0.756418 0.512833 0.592444 O\n0.756418 0.512833 0.907555 O\n0.243585 0.487168 0.092444 O\n0.914844 0.829684 0.250000 O\n0.085159 0.170317 0.750000 O\n0.500001 -0.000000 0.000000 O\n0.500001 -0.000000 0.500000 O\n",
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"formula_full": "Sb4 O8",
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"spacegroup": 63
},
{
"id": "jvasp-10636",
"created_at": "2022-09-04T14:37:28.371484Z",
"updated_at": "2022-09-04T14:37:28.371500Z",
"structure_string": "Sb4 O8\n1.0\n7.120145 -0.357803 -0.253004\n3.250207 5.629524 0.000000\n3.250208 1.876508 5.307566\nSb O\n4 8\ndirect\n0.291450 0.236184 0.236184 Sb\n0.633398 0.108557 0.629023 Sb\n0.633399 0.629022 0.108556 Sb\n0.633399 0.629022 0.629023 Sb\n0.446580 0.351134 0.351135 O\n0.446580 0.351134 0.851151 O\n0.446580 0.851150 0.351135 O\n0.778863 0.407046 0.407046 O\n0.437166 0.854277 0.854278 O\n0.794979 0.433824 0.885600 O\n0.794980 0.885599 0.433824 O\n0.794980 0.885599 0.885600 O\n",
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}
]
}